tert-butyl acetate


acetic acid tert-butyl ester; acetic acid 1,1-dimethylethyl ester; tert-butyl acetate; 1,1-dimethylethyl ethanoate; t-butyl acetate
Links:📏 NIST, ⚗️ ChemSynthesis, 📖 PubMed
CAS RN:[540-88-5]
Formula:C6H12O2; 116.16 g/mol
InChiKey:WMOVHXAZOJBABW-UHFFFAOYSA-N
SMILES:CC(=O)OC(C)(C)C
Molecular structure of tert-butyl acetate
Toxicology (LD50):4 100 mg/Kg (rat, or)
Density:0.867 g/mL
Molar volume:134.0 mL/mol
Refractive index:1.386
Molecular refractive power:31.47 mL/mol
Dipole moment:1.93 D
Melting point:-62 °C
Boiling point:97 °C
Vapour pressure:6 Torr
Surface tension:22.45 dyn/cm
Critical pressure:3.2 atm
Evaporation rate (butyl acetate):2.8
Log10 partition octanol / water:1.79
Hansen solubility parameter:δd: 7.0 (cal/mL)^0.5   δp: 1.7 (cal/mL)^0.5   δh: 2.9 (cal/mL)^0.5

Isomers

butyl acetate
Molecular structure of butyl acetate
tert-butyl acetate
Molecular structure of tert-butyl acetate
(1R,2R)-trans-1,2-cyclohexanediol
Molecular structure of (1R,2R)-trans-1,2-cyclohexanediol
cis-1,2-cyclohexanediol
Molecular structure of cis-1,2-cyclohexanediol
trans-1,2-cyclohexanediol
Molecular structure of trans-1,2-cyclohexanediol
(1S,2S)-trans-1,2-cyclohexanediol
Molecular structure of (1S,2S)-trans-1,2-cyclohexanediol
cis-1,4-cyclohexanediol
Molecular structure of cis-1,4-cyclohexanediol
trans-1,4-cyclohexanediol
Molecular structure of trans-1,4-cyclohexanediol
cyclohexylhydroperoxide
Molecular structure of cyclohexylhydroperoxide
2,2-dimethylbutanoic acid
Molecular structure of 2,2-dimethylbutanoic acid
2,3-dimethylbutanoic acid
Molecular structure of 2,3-dimethylbutanoic acid
3,3-dimethylbutanoic acid
Molecular structure of 3,3-dimethylbutanoic acid
(E)-2,3-dimethyl-2-butene-1,4-diol
Molecular structure of (E)-2,3-dimethyl-2-butene-1,4-diol
(Z)-2,3-dimethyl-2-butene-1,4-diol
Molecular structure of (Z)-2,3-dimethyl-2-butene-1,4-diol
2,3-epoxypropyl isopropyl ether
Molecular structure of 2,3-epoxypropyl isopropyl ether
4-ethenoxy-1-butanol
Molecular structure of 4-ethenoxy-1-butanol
ethyl butanoate
Molecular structure of ethyl butanoate
2-ethylbutanoic acid
Molecular structure of 2-ethylbutanoic acid
2-ethyl-2-methyl-1,3-dioxolane
Molecular structure of 2-ethyl-2-methyl-1,3-dioxolane
ethyl 2-methylpropanoate
Molecular structure of ethyl 2-methylpropanoate
3-ethyl-3-oxetanemethanol
Molecular structure of 3-ethyl-3-oxetanemethanol
hexanoic acid
Molecular structure of hexanoic acid
3-hydroxy-2,2-dimethyltetrahydrofuran
Molecular structure of 3-hydroxy-2,2-dimethyltetrahydrofuran
(R)-5-hydroxyhexanal
Molecular structure of (R)-5-hydroxyhexanal
4-hydroxyhexan-3-one
Molecular structure of 4-hydroxyhexan-3-one
6-hydroxy-2-hexanone
Molecular structure of 6-hydroxy-2-hexanone
2-hydroxy-2-methyloxane
Molecular structure of 2-hydroxy-2-methyloxane
4-hydroxy-4-methylpentan-2-one
Molecular structure of 4-hydroxy-4-methylpentan-2-one
2-(hydroxymethyl)tetrahydropyran
Molecular structure of 2-(hydroxymethyl)tetrahydropyran
4-(hydroxymethyl)tetrahydropyran
Molecular structure of 4-(hydroxymethyl)tetrahydropyran
isopropyl propanoate
Molecular structure of isopropyl propanoate
2-methoxyoxane
Molecular structure of 2-methoxyoxane
5-methoxypentanal
Molecular structure of 5-methoxypentanal
3-methylbutyl formate
Molecular structure of 3-methylbutyl formate
methyl 2,2-dimethylpropanoate
Molecular structure of methyl 2,2-dimethylpropanoate
2-(1-methylethyl)-1,3-dioxolane
Molecular structure of 2-(1-methylethyl)-1,3-dioxolane
methyl 2-methylbutanoate
Molecular structure of methyl 2-methylbutanoate
methyl 3-methylbutanoate
Molecular structure of methyl 3-methylbutanoate
methyl pentanoate
Molecular structure of methyl pentanoate
2-methylpentanoic acid
Molecular structure of 2-methylpentanoic acid
3-methylpentanoic acid
Molecular structure of 3-methylpentanoic acid
4-methylpentanoic acid
Molecular structure of 4-methylpentanoic acid
1-methylpropyl acetate
Molecular structure of 1-methylpropyl acetate
2-methylpropyl acetate
Molecular structure of 2-methylpropyl acetate
pentyl formate
Molecular structure of pentyl formate
3-pentyl formate
Molecular structure of 3-pentyl formate
propyl propanoate
Molecular structure of propyl propanoate
2,2,4-trimethyl-1,3-dioxolane
Molecular structure of 2,2,4-trimethyl-1,3-dioxolane