Flavanone
-
Identifiers
CAS number
487-26-3Molecular formula
C15H12O2SMILES
C1C(OC2=CC=CC=C2C1=O)C3=CC=CC=C3
Safety labels
Irritant -
Odor profile
Fragrance Sweet 67.67% Coumarinic 56.37% Herbal 53.51% Spicy 50.54% Floral 41.32% Hay 40.94% Phenolic 40.61% Coconut 38.44% Balsamic 37.19% Aromatic 35.93% Flavor Bitter 74.86% Herbal 51.33% Sweet 49.9% Balsam 40.3% Tonka 39.4% Coconut 27.44% Tobacco 24.87% Anise 24.39% Coumarin 23.98% Almond 23.53% Odor impact est.
Medium -
Properties
XLogP3-AA
3.2pKa est.
7.66 (neutral)Molecular weight
224.25 g/molVapor pressure est.
- hPa @ 20°C
- hPa @ 25°C
Evaporation rate
Ultra slowBoiling point est.
384°CFlash point
- 168.25 ˚C est.
-
Synonyms
- FLAVANONE
- 487-26-3
- 2,3-Dihydroflavone
- 4-Flavanone
- 2-Phenyl-4-chromanone
- 2,3-Dihydro-2-phenyl-4H-1-benzopyran-4-one
- 4H-1-Benzopyran-4-one, 2,3-dihydro-2-phenyl-
- NSC-50393
- WX22P730FB
- DTXSID9022318
- 2-phenyl-2,3-dihydrochromen-4-one
- CHEBI:5070
- (+-)-flavanone
- RefChem:140598
- GlyTouCan:G01395YK
- DTXCID302318
- G01395YK
- 207-654-8
- 2-Phenylchroman-4-one
- Flavanone-d5
- MFCD00006841
- 2,3-Dihydro-2-phenyl-4H-benzopyran-4-one
- 2-Phenylchromanone
- 2-phenyl-3,4-dihydro-2H-1-benzopyran-4-one
- 2-Phenyl-2,3-dihydro-4H-chromen-4-one
- Propafenone EP Impurity H
- Flavonoid
- MLS002667384
- CHEMBL274318
- NSC50393
- (2RS)-2-Phenyl-2,3-dihydro-4H-1-benzopyran-4-one
- SMR001306759
- 2-Phenyl-chroman-4-one
- EINECS 207-654-8
- NSC 50393
- BRN 0183227
- UNII-WX22P730FB
- Propafenone IMpurity H (EP/BP/USP)
- flavan-4-one
- Propafenone Hydrochloride Imp. H (EP); Propafenone Imp. H (EP); (2RS)-2-Phenyl-2,3-dihydro-4H-1-benzopyran-4-one; Propafenone Hydrochloride Impurity H; Propafenone Impurity H
- Flavanone, 98%
- (+/-)-flavanone
- 2-phenyl-2
- DL-FLAVANONE
- Spectrum_000081
- SpecPlus_000724
- Spectrum2_000205
- Spectrum3_000174
- Spectrum4_001646
- Spectrum5_000491
- Flavone, 2,3-dihydro-
- (2R)-2-phenyl-3,4-dihydro-2H-1-benzopyran-4-one
- Oprea1_401736
- SCHEMBL19745
- BSPBio_001667
- GTPL408
- KBioGR_002111
- KBioSS_000501
- SPECTRUM200343
- 5-17-10-00480 (Beilstein Handbook Reference)
- MLS002207195
- DivK1c_006820
- SPBio_000189
- MEGxp0_001684
- orb1310525
- FLAVANONE, (+/-)-
- SCHEMBL15201568
- SCHEMBL29470801
- ACon1_002246
- KBio1_001764
- KBio2_000501
- KBio2_003069
- KBio2_005637
- KBio3_001167
- ZONYXWQDUYMKFB-UHFFFAOYSA-
- BB_NC-02811
- HY-N7128
- WFA19691
- BBL027613
- BDBM50051358
- CCG-21177
- EBC-04233
- s3679
- SBB042502
- STL373060
- AKOS000120276
- AKOS016040110
- FF23297
- NCGC00095802-01
- NCGC00095802-02
- NCGC00095802-03
- NCGC00095802-05
- AS-48159
- DA-53215
- NCI60_004213
- ST098942
- SY049235
- 2-Phenyl-2,3-dihydro-4H-chromen-4-one #
- CS-0030762
- EU-0012871
- F0255
- NS00007587
- 4H-1-Benzopyran-4-one,3-dihydro-2-phenyl-
- EN300-17915
- 2-Phenyl-2,3-dihydro-4H-1-benzopyran-4-one
- C00766
- F19539
- F358200
- L000786
- SR-01000500943
- F4C11F5A-DFFA-4E0E-BCC9-2FD60204B2DD
- SR-01000500943-1
- BRD-A07824748-001-02-6
- BRD-A07824748-001-03-4
- Q27077305
- Z57085783
- PROPAFENONE HYDROCHLORIDE IMPURITY H [EP IMPURITY]
- InChI=1/C15H12O2/c16-13-10-15(11-6-2-1-3-7-11)17-14-9-5-4-8-12(13)14/h1-9,15H,10H2
- 487-26-3
-
Applications
Flavanone (CAS 487-26-3) is used primarily as an organic synthesis intermediate and building block for flavonoid-related compounds. In pharmaceutical research, it serves as a precursor for various flavonoid derivatives and related medicinal chemistries. In agrochemical development, it is evaluated as a starting material for the synthesis of flavonoid-like intermediates aimed at crop protection research. In the fine chemicals sector, it supports pilot-scale synthesis and downstream transformations as a versatile starting point for further chemical elaboration. In fragrance and flavor chemistry contexts, it may be explored as a precursor for aroma compound synthesis. Use is typically subject to local regulations and formulation limits.
gpt-5-nano
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Solubility @25˚C
Solvent Solubility (g/L) ethanol 14.08 methanol 19.7 isopropanol 10.41 water 0.2 ethyl acetate 89.71 n-propanol 14.02 acetone 91.41 n-butanol 15.3 acetonitrile 102.56 DMF 181.1 toluene 58.91 isobutanol 12.19 1,4-dioxane 282.44 methyl acetate 112.99 THF 214.3 2-butanone 97.95 n-pentanol 18.4 sec-butanol 10.83 n-hexane 1.64 ethylene glycol 12.14 NMP 123.46 cyclohexane 5.04 DMSO 191.9 n-butyl acetate 75.39 n-octanol 15.19 chloroform 400.74 n-propyl acetate 80.7 acetic acid 63.62 dichloromethane 429.98 cyclohexanone 155.4 propylene glycol 9.54 isopropyl acetate 54.1 DMAc 234.71 2-ethoxyethanol 56.49 isopentanol 20.84 n-heptane 3.5 ethyl formate 72.84 1,2-dichloroethane 309.51 n-hexanol 22.06 2-methoxyethanol 75.2 isobutyl acetate 55.85 tetrachloromethane 18.37 n-pentyl acetate 40.16 transcutol 569.43 n-heptanol 14.52 ethylbenzene 37.49 MIBK 51.91 2-propoxyethanol 70.49 tert-butanol 21.47 MTBE 29.45 2-butoxyethanol 44.25 propionic acid 42.12 o-xylene 36.76 formic acid 22.13 diethyl ether 44.17 m-xylene 34.9 p-xylene 46.12 chlorobenzene 119.46 dimethyl carbonate 79.39 n-octane 1.9 formamide 65.35 cyclopentanone 171.91 2-pentanone 62.56 anisole 110.97 cyclopentyl methyl ether 61.06 gamma-butyrolactone 225.29 1-methoxy-2-propanol 50.37 pyridine 228.59 3-pentanone 70.92 furfural 248.44 n-dodecane 2.76 diethylene glycol 72.3 diisopropyl ether 16.0 tert-amyl alcohol 17.54 acetylacetone 144.18 n-hexadecane 3.31 acetophenone 108.01 methyl propionate 80.13 isopentyl acetate 71.8 trichloroethylene 560.65 n-nonanol 17.05 cyclohexanol 26.31 benzyl alcohol 62.86 2-ethylhexanol 23.88 isooctanol 16.22 dipropyl ether 39.26 1,2-dichlorobenzene 117.69 ethyl lactate 42.53 propylene carbonate 126.35 n-methylformamide 67.44 2-pentanol 10.75 n-pentane 1.12 1-propoxy-2-propanol 48.3 1-methoxy-2-propyl acetate 93.84 2-(2-methoxypropoxy) propanol 85.71 mesitylene 23.38 ε-caprolactone 126.25 p-cymene 25.23 epichlorohydrin 325.48 1,1,1-trichloroethane 133.8 2-aminoethanol 16.09 morpholine-4-carbaldehyde 210.62 sulfolane 212.22 2,2,4-trimethylpentane 2.2 2-methyltetrahydrofuran 86.69 n-hexyl acetate 59.7 isooctane 1.91 2-(2-butoxyethoxy)ethanol 107.35 sec-butyl acetate 54.84 tert-butyl acetate 58.32 decalin 6.44 glycerin 27.12 diglyme 274.05 acrylic acid 54.68 isopropyl myristate 32.14 n-butyric acid 52.79 acetyl acetate 94.83 di(2-ethylhexyl) phthalate 33.65 ethyl propionate 74.67 nitromethane 223.97 1,2-diethoxyethane 138.14 benzonitrile 114.94 trioctyl phosphate 20.52 1-bromopropane 63.37 gamma-valerolactone 235.4 n-decanol 14.73 triethyl phosphate 47.08 4-methyl-2-pentanol 13.31 propionitrile 69.86 vinylene carbonate 154.56 1,1,2-trichlorotrifluoroethane 155.09 DMS 105.96 cumene 25.85 2-octanol 9.82 2-hexanone 70.83 octyl acetate 35.31 limonene 29.21 1,2-dimethoxyethane 178.43 ethyl orthosilicate 41.77 tributyl phosphate 31.92 diacetone alcohol 64.18 N,N-dimethylaniline 61.57 acrylonitrile 131.0 aniline 67.2 1,3-propanediol 26.58 bromobenzene 134.83 dibromomethane 202.33 1,1,2,2-tetrachloroethane 337.4 2-methyl-cyclohexyl acetate 61.32 tetrabutyl urea 42.47 diisobutyl methanol 19.78 2-phenylethanol 56.06 styrene 54.65 dioctyl adipate 56.62 dimethyl sulfate 114.34 ethyl butyrate 71.55 methyl lactate 46.84 butyl lactate 39.2 diethyl carbonate 64.86 propanediol butyl ether 38.84 triethyl orthoformate 56.14 p-tert-butyltoluene 21.98 methyl 4-tert-butylbenzoate 72.24 morpholine 174.14 tert-butylamine 12.76 n-dodecanol 13.28 dimethoxymethane 127.56 ethylene carbonate 118.99 cyrene 81.65 2-ethoxyethyl acetate 86.37 2-ethylhexyl acetate 58.73 1,2,4-trichlorobenzene 132.75 4-methylpyridine 140.83 dibutyl ether 40.25 2,6-dimethyl-4-heptanol 19.78 DEF 96.88 dimethyl isosorbide 149.59 tetrachloroethylene 185.31 eugenol 73.17 triacetin 103.98 span 80 52.68 1,4-butanediol 13.83 1,1-dichloroethane 138.63 2-methyl-1-pentanol 24.6 methyl formate 80.74 2-methyl-1-butanol 16.57 n-decane 3.78 butyronitrile 52.14 3,7-dimethyl-1-octanol 23.5 1-chlorooctane 17.8 1-chlorotetradecane 10.19 n-nonane 3.03 undecane 3.15 tert-butylcyclohexane 5.16 cyclooctane 2.36 cyclopentanol 25.32 tetrahydropyran 111.85 tert-amyl methyl ether 25.63 2,5,8-trioxanonane 184.92 1-hexene 10.29 2-isopropoxyethanol 46.35 2,2,2-trifluoroethanol 39.73 methyl butyrate 93.56 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 |