trans-2-Hexenoic acid
Properties
- Molecular formula
- C6H10O2
- Molar mass
- 114.14 g/mol
- Exact mass
- 114.0681 Da
- Density
- 0.9469 g/mL (at 20 °C)
- Melting point
- 30–32 °C
- Boiling point
- 98–102 °C (at 8 Torr)
- logP
- 1.43Crippen estimate
- Polar surface area
- 37.3 Ų
- H-bond donors / acceptors
- 1 / 1
- Rotatable bonds
- 3
- Double bonds
- EE/Z, in SMILES order
Hazards
Danger
- H314 Causes severe skin burns and eye damage100% of notifiers
Aggregated from 1,509 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P260, P264, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P321, P363, P405, P501
Identifiers
CAS number
13419-69-7SMILES
CCC/C=C/C(=O)OInChIKey
NIONDZDPPYHYKY-SNAWJCMRSA-NInChI
InChI=1S/C6H10O2/c1-2-3-4-5-6(7)8/h4-5H,2-3H2,1H3,(H,7,8)/b5-4+Weigh it out
Type any one amount. The others follow from the molar mass and density.
Names and synonyms
4 names
- 2-Hexenoic acid, (2E)-
- 2-Hexenoic acid, (E)-
- (2E)-2-Hexenoic acid
- (E)-2-Hexenoic acid
Work with trans-2-Hexenoic acid
Stereoisomers, salts and isotopologues
The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.
Similar compounds
trans-2-Octenoic acid1871-67-674 % similar
Dodec-2-enoic acid32466-54-971 % similar
trans-2-Decenoic acid334-49-671 % similar
2-Nonenoic acid3760-11-071 % similar
trans-2-Decenoic acid72881-27-771 % similar
trans-2-Pentenoic acid13991-37-262 % similar
3-Hepten-2-one1119-44-454 % similar
Methyl 2-hexenoate2396-77-253 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.