Isopropyl isobutyrate
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Identifiers
CAS number
617-50-5Molecular formula
C7H14O2SMILES
CC(C)C(=O)OC(C)C
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Odor profile
fruity 98.39% sweet 79.67% pineapple 69.09% apple 67.33% ethereal 65.73% banana 63.61% tropical 57.82% rummy 46.94% ripe 44.55% green 43.99% Scent© AI
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Properties
XLogP3-AA
2.0 Well soluble in DEP, MMB, TECMolecular weight
130.18 g/molBoiling points
- 120.00 to 121.00 °C. @ 760.00 mm Hg
Solubilities
- insoluble in water; soluble in most organic solvents
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Synonyms
- ISOPROPYL ISOBUTYRATE
- 617-50-5
- Isobutyric Acid Isopropyl Ester
- Isopropyl 2-methylpropanoate
- propan-2-yl 2-methylpropanoate
- Isobutyric acid, isopropyl ester
- Propanoic acid, 2-methyl-, 1-methylethyl ester
- FEMA No. 2937
- 1-Methylethyl 2-methylpropanoate
- UNII-IB2671N3UT
- IB2671N3UT
- Isopropyl isobutanoate
- EINECS 210-517-5
- FEMA 2937
- iso-C3H7C(O)OCH(CH3)2
- DTXSID10862297
- ISOPROPYL ISOBUTYRATE [FHFI]
- UN 2406
- isopropylisobutyrat
- MFCD00059365
- UN2406
- SCHEMBL295903
- Isopropyl isobutyrate, >=99%
- Isopropyl 2-methylpropanoic acid
- DTXCID70811084
- CHEBI:179991
- Propan-2-yl 2-methylpropanoic acid
- AKOS008948133
- LS-13336
- DB-319679
- I0109
- NS00042647
- D91082
- Isopropyl isobutyrate [UN2406] [Flammable liquid]
- Isopropyl isobutyrate [UN2406] [Flammable liquid]
- Q27280641
- 210-517-5
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Botanical
Name | CAS | Botanical | Proportion |
---|---|---|---|
Passion fruit (China) 2 | Passiflora edulis Sims var. flavicarpa Dengener, fam. Passifloraceae | 0.29% | |
Ruta chalepensis (Turkey) | Ruta chalepensis L., fam. Rutaceae | 0.02% | |
Carob bean extract 1 | 9000-40-2 | Ceratonia siliqua L., fam. Leguminoseae | 0.01% |