Azadirachtin
-
Identifiers
CAS number
11141-17-6Molecular formula
C35H44O16SMILES
C/C=C(\C)/C(=O)O[C@H]1C[C@H]([C@]2(CO[C@@H]3[C@@H]2[C@]14CO[C@@]([C@H]4[C@]([C@@H]3O)(C)[C@@]56[C@@H]7C[C@H]([C@@]5(O6)C)[C@]8(C=CO[C@H]8O7)O)(C(=O)OC)O)C(=O)OC)OC(=O)C
Safety labels
Irritant
Environmental -
Odor profile
Fragrance Odorless 58.41% Sweet 21.23% Mint 20.95% Cooling 20.29% Milky 17.36% Roasted 17.35% Woody 17.14% Lactonic 16.78% Nutty 16.68% Fresh 16.64% Flavor Bitter 91.87% Bland 25.98% Sweet-like 22.81% Cedarleaf 21.32% Odorless 20.75% Parsley 19.56% Ripe apricot 19.37% Broom 18.94% Heather 18.86% Red fruit 18.85% Odor impact est.
Low -
Properties
XLogP3-AA
-0.6pKa est.
3.14 (weak acid)Molecular weight
720.7 g/molVapor pressure est.
- hPa @ 20°C
- hPa @ 25°C
Evaporation rate
Moderately fastBoiling point est.
769°CMelting point expt.
- 154-158 °C
Flash point
- 184.57 ˚C est.
- Flash point > 58 °C
- >137 °F (Closed cup)
Solubility expt.
- Readily soluble in ethanol, diethyl ether, acetone, and chloroform. Insoluble in hexane.
- In water, 0.26 g/L at 25 °C
-
Synonyms
- azadirachtin
- 11141-17-6
- Azadirachtin A
- Nimbicidine
- NeemAzal
- bioneem
- Nimurin
- Ornazin
- Azatin
- Suneem
- Superneem
- Ecozin
- Gronim
- Oikos
- Safer BioNEEM
- O4U1SAF85H
- BIOSAL
- CHEBI:2942
- DTXSID0037497
- NSC-368675
- azadyrachtin
- 1H,7H-Naphtho(1,8-bc:4,4a-c')difuran-5,10a(8H)-dicarboxylic acid, 10-(acetyloxy)octahydro-3,5-dihydroxy-4-methyl-8-(((2E)-2-methyl-1-oxo-2-butenyl)oxy)-4-((1aR,2S,3aS,6aS,7S,7aS)-3a,6a,7,7a-tetrahydro-6a-hydroxy-7a-methyl-2,7-methanofuro(2,3-b)oxireno(e)oxepin-1a(2H)-yl)-, dimethyl ester, (2aR,3S,4S,4aR,5S,7aS,8S,10R,10aS,10bR)-
- dimethyl (1S,4S,5R,6S,7S,8R,11S,12R,14S,15R)-12-acetyloxy-4,7-dihydroxy-6-[(1S,2S,6S,8S,9R,11S)-2-hydroxy-11-methyl-5,7,10-trioxatetracyclo[6.3.1.02,6.09,11]dodec-3-en-9-yl]-6-methyl-14-[(E)-2-methylbut-2-enoyl]oxy-3,9-dioxatetracyclo[6.6.1.01,5.011,15]pentadecane-4,11-dicarboxylate
- dimethyl (1S,4S,5R,6S,7S,8R,11S,12R,14S,15R)-12-acetyloxy-4,7-dihydroxy-6-((1S,2S,6S,8S,9R,11S)-2-hydroxy-11-methyl-5,7,10-trioxatetracyclo(6.3.1.02,6.09,11)dodec-3-en-9-yl)-6-methyl-14-((E)-2-methylbut-2-enoyl)oxy-3,9-dioxatetracyclo(6.6.1.01,5.011,15)pentadecane-4,11-dicarboxylate
- RefChem:560444
- DTXCID8017497
- CHEBI:38473
- 601-089-4
- AZADIRACTIN
- C35H44O16
- Azadirachtin-A
- Align
- HSDB 7372
- dimethyl acetoxy-dihydroxy-[hydroxy(methyl)[?]yl]-methyl-[(E)-2-methylbut-2-enoyl]oxy-[?]dicarboxylate
- NSC 368675
- Azadirachtin (Standard)
- Azadirachtin 100 microg/mL in Acetonitrile
- AZADIRACHTIN [MI]
- UNII-O4U1SAF85H
- SCHEMBL27784
- CCRIS 9142
- CHEMBL509309
- orb1297455
- orb3025898
- GLXC-23432
- MSK20401
- BDBM50634024
- AKOS040760284
- EBC-615467
- HY-126741R
- LMPR0106100001
- NCGC00163746-01
- DA-50844
- MS-31232
- HY-126741
- CS-0107060
- C08748
- Q793471
- 176087-49-3
- 1H,7H-Naphtho[1,8-bc:4,4a-c']difuran-5,10a(8H)-dicarboxylic acid, 10-(acetyloxy)octahydro-3,5-dihydroxy-4-methyl-8-[[(2E)-2-methyl-1-oxo-2-buten-1-yl]oxy]-4-[(1aR,2S,3aS,6aS,7S,7aS)-3a,6a,7,7a-tetrahydro-6a-hydroxy-7a-methyl-2,7-methanofuro[2,3-b]oxireno[e]oxepin-1a(2H)-yl]-, 5,10a-dimethyl ester, (2aR,3S,4S,4aR,5S,7aS,8S,10R,10aS,10bR)-
- 4,11-dimethyl (1S,4S,5R,6S,7S,8R,11S,12R,14S,15R)-12-(acetyloxy)-4,7-dihydroxy-6-[(1S,2S,6S,8S,9R,11S)-2-hydroxy-11-methyl-5,7,10-trioxatetracyclo[6.3.1.0^{2,6}.0^{9,11}]dodec-3-en-9-yl]-6-methyl-14-{[(2E)-2-methylbut-2-enoyl]oxy}-3,9-dioxatetracyclo[6.6.1.0^{1,5}.0^{11,15}]pentadecane-4,11-dicarboxylate
- dimethyl (1S,4S,5R,6S,7S,8R,11S,12R,14S,15R)-12-acetoxy-4,7-dihydroxy-6-[(1S,2S,6S,8S,9R,11S)-2-hydroxy-11-methyl-5,7,10-trioxatetracyclo[6.3.1.02,6.09,11]dodec-3-en-9-yl]-6-methyl-14-[(E)-2-methylbut-2-enoyl]oxy-3,9-dioxatetracyclo[6.6.1.01,5.011,15]pentadecane-4,11-dicarboxylate
- Dimethyl (1S,4S,5R,6S,7S,8R,11S,12R,14S,15R)-12-acetyloxy-4,7-dihydroxy-6-[(1S,2S,6S,9R,11S)-2-hydroxy-11-methyl-5,7,10-trioxatetracyclo[6.3.1.02,6.09,11]dodec-3-en-9-yl]-6-methyl-14-[(E)-2-methylbut-2-enoyl]oxy-3,9-dioxatetracyclo[6.6.1.01,5.011,15]pentadecane-4,11-dicarboxylate
- Dimethyl (2aR,3S,4S,4aR,5S,7aS,8S,10R,10aS,10bR)-10-(acetyloxy)-3,5-dihydroxy-4-[(1aR,2S,3aS,6aS,7S,7aS)-6a-hydroxy-7a-methyl-3a,6a,7,7a-tetrahydro-2,7-methanofuro[2,3-b]oxireno[e]oxepin-1a(2H)-yl]-4-methyl-8-{[(2E)-2-methylbut-2-enoyl]oxy}octahydro-1H,7H-naphtho[1,8a-c:4,5-b'c']difuran-5,10a(8H)-dicarboxylate
- dimethyl (2aR,3S,4S,4aR,5S,7aS,8S,10R,10aS,10bR)-10-acetoxy-3,5-dihydroxy-4-[(1aR,2S,3aS,6aS,7S,7aS)-6a-hydroxy-7a-methyl-3a,6a,7,7a-tetrahydro-2,7-methanofuro[2,3-b]oxireno[e]oxepin-1a(2H)-yl]-4-methyl-8-{[(2E)-2-methylbut-2-enoyl]oxy}octahydro-1H-naphtho[1,8a-c:4,5-b'c']difuran-5,10a(8H)-dicarboxylate
- 11141-17-6
-
Applications
Azadirachtin (CAS 11141-17-6) is a botanical insecticide derived from Azadirachta indica (neem). It is primarily used as an active ingredient in biopesticide formulations for pest management, acting as an insect growth regulator and antifeedant. Real-world applications include crop protection in field agriculture and greenhouse/ornamental horticulture, where it helps suppress pests such as aphids, whiteflies, and thrips; use in home/garden pest control products for residential or small-scale applications; protection of stored products against insects in post-harvest storage; and integration into pest management programs (IPM) to reduce reliance on conventional synthetic insecticides. All uses are subject to local regulations and formulation limits.
gpt-5-nano
-
Solubility @25˚C
Solvent Solubility (g/L) ethanol 8.8 methanol 55.02 isopropanol 2.57 water 0.43 ethyl acetate 12.57 n-propanol 5.63 acetone 38.29 n-butanol 2.59 acetonitrile 21.83 DMF 227.53 toluene 2.47 isobutanol 2.35 1,4-dioxane 28.36 methyl acetate 24.61 THF 42.0 2-butanone 18.23 n-pentanol 2.35 sec-butanol 1.9 n-hexane 0.07 ethylene glycol 18.88 NMP 238.26 cyclohexane 0.1 DMSO 147.64 n-butyl acetate 4.58 n-octanol 1.24 chloroform 25.41 n-propyl acetate 7.38 acetic acid 140.81 dichloromethane 30.25 cyclohexanone 22.65 propylene glycol 13.9 isopropyl acetate 5.09 DMAc 142.25 2-ethoxyethanol 27.68 isopentanol 1.39 n-heptane 0.07 ethyl formate 17.92 1,2-dichloroethane 12.06 n-hexanol 1.52 2-methoxyethanol 62.22 isobutyl acetate 3.19 tetrachloromethane 1.72 n-pentyl acetate 4.39 transcutol 20.61 n-heptanol 1.53 ethylbenzene 0.81 MIBK 3.78 2-propoxyethanol 25.45 tert-butanol 1.82 MTBE 1.48 2-butoxyethanol 11.87 propionic acid 25.4 o-xylene 1.24 formic acid 157.71 diethyl ether 3.29 m-xylene 1.09 p-xylene 1.11 chlorobenzene 4.5 dimethyl carbonate 34.89 n-octane 0.04 formamide 151.81 cyclopentanone 60.68 2-pentanone 9.71 anisole 4.48 cyclopentyl methyl ether 6.88 gamma-butyrolactone 105.0 1-methoxy-2-propanol 28.38 pyridine 32.77 3-pentanone 8.86 furfural 99.86 n-dodecane 0.03 diethylene glycol 36.68 diisopropyl ether 0.46 tert-amyl alcohol 1.56 acetylacetone 30.96 n-hexadecane 0.04 acetophenone 9.5 methyl propionate 22.65 isopentyl acetate 2.95 trichloroethylene 48.01 n-nonanol 1.29 cyclohexanol 1.87 benzyl alcohol 6.89 2-ethylhexanol 0.8 isooctanol 1.03 dipropyl ether 1.97 1,2-dichlorobenzene 4.41 ethyl lactate 10.19 propylene carbonate 33.27 n-methylformamide 119.34 2-pentanol 0.96 n-pentane 0.07 1-propoxy-2-propanol 10.85 1-methoxy-2-propyl acetate 12.18 2-(2-methoxypropoxy) propanol 9.37 mesitylene 0.47 ε-caprolactone 24.87 p-cymene 0.47 epichlorohydrin 66.6 1,1,1-trichloroethane 5.69 2-aminoethanol 19.6 morpholine-4-carbaldehyde 149.0 sulfolane 150.6 2,2,4-trimethylpentane 0.03 2-methyltetrahydrofuran 10.05 n-hexyl acetate 4.27 isooctane 0.02 2-(2-butoxyethoxy)ethanol 11.57 sec-butyl acetate 3.02 tert-butyl acetate 4.12 decalin 0.06 glycerin 43.89 diglyme 25.0 acrylic acid 56.88 isopropyl myristate 1.08 n-butyric acid 14.99 acetyl acetate 16.16 di(2-ethylhexyl) phthalate 3.07 ethyl propionate 6.85 nitromethane 310.91 1,2-diethoxyethane 4.84 benzonitrile 7.88 trioctyl phosphate 1.77 1-bromopropane 2.23 gamma-valerolactone 155.72 n-decanol 0.79 triethyl phosphate 2.7 4-methyl-2-pentanol 0.56 propionitrile 8.96 vinylene carbonate 47.21 1,1,2-trichlorotrifluoroethane 87.03 DMS 9.53 cumene 0.43 2-octanol 0.7 2-hexanone 6.17 octyl acetate 2.22 limonene 0.61 1,2-dimethoxyethane 27.88 ethyl orthosilicate 2.02 tributyl phosphate 1.76 diacetone alcohol 10.32 N,N-dimethylaniline 3.01 acrylonitrile 28.06 aniline 5.3 1,3-propanediol 16.16 bromobenzene 3.79 dibromomethane 9.85 1,1,2,2-tetrachloroethane 21.94 2-methyl-cyclohexyl acetate 3.53 tetrabutyl urea 3.16 diisobutyl methanol 0.37 2-phenylethanol 5.1 styrene 1.18 dioctyl adipate 3.31 dimethyl sulfate 70.56 ethyl butyrate 4.24 methyl lactate 32.91 butyl lactate 6.62 diethyl carbonate 3.55 propanediol butyl ether 11.27 triethyl orthoformate 3.27 p-tert-butyltoluene 0.41 methyl 4-tert-butylbenzoate 7.39 morpholine 31.23 tert-butylamine 0.49 n-dodecanol 0.48 dimethoxymethane 67.59 ethylene carbonate 26.7 cyrene 32.65 2-ethoxyethyl acetate 12.25 2-ethylhexyl acetate 2.31 1,2,4-trichlorobenzene 7.24 4-methylpyridine 16.65 dibutyl ether 0.85 2,6-dimethyl-4-heptanol 0.37 DEF 20.93 dimethyl isosorbide 19.56 tetrachloroethylene 14.53 eugenol 9.89 triacetin 11.59 span 80 8.08 1,4-butanediol 8.23 1,1-dichloroethane 6.53 2-methyl-1-pentanol 1.34 methyl formate 107.75 2-methyl-1-butanol 1.54 n-decane 0.06 butyronitrile 4.47 3,7-dimethyl-1-octanol 0.76 1-chlorooctane 0.41 1-chlorotetradecane 0.14 n-nonane 0.05 undecane 0.04 tert-butylcyclohexane 0.04 cyclooctane 0.04 cyclopentanol 4.76 tetrahydropyran 7.05 tert-amyl methyl ether 1.49 2,5,8-trioxanonane 16.38 1-hexene 0.34 2-isopropoxyethanol 11.32 2,2,2-trifluoroethanol 54.97 methyl butyrate 9.09 Scent© AI
| Maximum acceptable concentrations in the finished product (%) | |||
|---|---|---|---|
|
Category 1
Products applied to the lips
|
No restriction |
Category 7A
Rinse-off products applied to the hair with some hand contact
|
No restriction |
|
Category 2
Products applied to the axillae
|
No restriction |
Category 7B
Leave-on products applied to the hair with some hand contact
|
No restriction |
|
Category 3
Products applied to the face/body using fingertips
|
No restriction |
Category 8
Products with significant anogenital exposure
|
No restriction |
|
Category 4
Products related to fine fragrance
|
No restriction |
Category 9
Products with body and hand exposure, primarily rinse off
|
No restriction |
|
Category 5A
Body lotion products applied to the body using the hands (palms), primarily leave on
|
No restriction |
Category 10A
Household care products with mostly hand contact
|
No restriction |
|
Category 5B
Face moisturizer products applied to the face using the hands (palms), primarily leave on
|
No restriction |
Category 10B
Household care products with mostly hand contact, including aerosol/spray products (with potential leave-on skin contact)
|
No restriction |
|
Category 5C
Hand cream products applied to the hands using the hands (palms), primarily leave on
|
No restriction |
Category 11A
Products with intended skin contact but minimal transfer of fragrance to skin from inert substrate without UV exposure
|
No restriction |
|
Category 5D
Baby Creams, baby Oils and baby talc
|
No restriction |
Category 11B
Products with intended skin contact but minimal transfer of fragrance to skin from inert substrate with potential UV exposure
|
No restriction |
|
Category 6
Products with oral and lip exposure
|
No restriction |
Category 12
Products not intended for direct skin contact, minimal or insignificant transfer to skin
|
No restriction |