Vaccenic acid
Properties
- Molecular formula
- C18H34O2
- Molar mass
- 282.47 g/mol
- Exact mass
- 282.2559 Da
- Melting point
- 44 °C
- Boiling point
- 125 °C (at 0.1 Torr)
- logP
- 6.11Crippen estimate
- Polar surface area
- 37.3 Ų
- H-bond donors / acceptors
- 1 / 1
- Rotatable bonds
- 15
- Double bonds
- EE/Z, in SMILES order
Hazards
Warning
- H315 Causes skin irritation97.5% of notifiers
- H319 Causes serious eye irritation97.5% of notifiers
- H335 May cause respiratory irritation97.5% of notifiers
Aggregated from 40 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501
Identifiers
CAS number
693-72-1SMILES
CCCCCC/C=C/CCCCCCCCCC(=O)OInChIKey
UWHZIFQPPBDJPM-BQYQJAHWSA-NInChI
InChI=1S/C18H34O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h7-8H,2-6,9-17H2,1H3,(H,19,20)/b8-7+Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
10 names
- 11-Octadecenoic acid, (11E)-
- 11-Octadecenoic acid, (E)-
- (11E)-11-Octadecenoic acid
- trans-11-Octadecenoic acid
- trans-Vaccenic acid
- (E)-11-Octadecenoic acid
- trans-δ11-Octadecenoic acid
- 11-trans-Octadecenoic acid
- 11(E)-Octadecenoic acid
- (E)-Octadec-11-enoic acid
Work with Vaccenic acid
Similar compounds
Erucic acid112-86-7100 % similar
Palmitoleic acid373-49-9100 % similar
9-Eicosenoic acid506-31-0100 % similar
Brassidic acid506-33-2100 % similar
Nervonic acid506-37-6100 % similar
11-Eicosenoic acid5561-99-9100 % similar
11,14-Eicosadienoic acid2091-39-690 % similar
Zirconium oleate42040-79-990 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.