cis-3-Hexenyl acetate
Properties
- Molecular formula
- C8H14O2
- Molar mass
- 142.20 g/mol
- Exact mass
- 142.0994 Da
- Boiling point
- 198 °C
- logP
- 1.91Crippen estimate
- Polar surface area
- 26.3 Ų
- H-bond donors / acceptors
- 0 / 2
- Rotatable bonds
- 4
Identifiers
CAS number
3681-71-8SMILES
CC/C=CCCOC(C)=OInChIKey
NPFVOOAXDOBMCE-PLNGDYQASA-NInChI
InChI=1S/C8H14O2/c1-3-4-5-6-7-10-8(2)9/h4-5H,3,6-7H2,1-2H3/b5-4-Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
15 names · show all
- 3-Hexen-1-ol, 1-acetate, (3Z)-
- 3-Hexen-1-ol, acetate, (Z)-
- 3-Hexen-1-ol, acetate, (3Z)-
- (Z)-3-Hexenyl acetate
- cis-3-Hexenyl ethanoate
- (Z)-3-Hexen-1-ol acetate
- (Z)-Hex-3-en-1-yl acetate
- cis-3-Hexenol acetate
- cis-Hex-3-en-1-yl acetate
- (Z)-3-Hexen-1-yl acetate
- (3Z)-Hexen-1-yl acetate
- 3Z-Hexenyl acetate
- cis-3-Hexen-1-ol acetate
- 3Z-Hexen-1-ol acetate
- Leaf acetate
Work with cis-3-Hexenyl acetate
Predict the NMR spectrum1H and 13C shifts with multiplicities
Make a solutionWhat to weigh for any molarity and volume
Check drug-likenessLipinski, Veber and lead-likeness
Boiling point under vacuumAt any pressure, from its normal boiling point
Isotope patternExact mass and the mass spectrum pattern
Similar compounds
3-Hexenyl acetate1708-82-3100 % similar
cis-3-Hexenyl propionate33467-74-259 % similar
cis-3-Hexenyl butanoate16491-36-456 % similar
cis-3-Hexenyl isobutyrate41519-23-756 % similar
(Z)-3-Hexenyl tiglate67883-79-856 % similar
(Z)-7-Dodecenyl acetate14959-86-554 % similar
(Z)-8-Dodecenyl acetate28079-04-154 % similar
(Z)-11-Hexadecenyl acetate34010-21-454 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds