Traumatic acid
Properties
- Molecular formula
- C12H20O4
- Molar mass
- 228.29 g/mol
- Exact mass
- 228.1362 Da
- Melting point
- 165.5 °C
- logP
- 2.83Crippen estimate
- Polar surface area
- 74.6 Ų
- H-bond donors / acceptors
- 2 / 2
- Rotatable bonds
- 10
- Double bonds
- EE/Z, in SMILES order
Hazards
Warning
- H315 Causes skin irritation100% of notifiers
- H319 Causes serious eye irritation100% 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
6402-36-4SMILES
O=C(O)/C=C/CCCCCCCCC(=O)OInChIKey
MAZWDMBCPDUFDJ-VQHVLOKHSA-NInChI
InChI=1S/C12H20O4/c13-11(14)9-7-5-3-1-2-4-6-8-10-12(15)16/h7,9H,1-6,8,10H2,(H,13,14)(H,15,16)/b9-7+Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
7 names
- 2-Dodecenedioic acid, (2E)-
- 2-Dodecenedioic acid, (E)-
- 2-Dodecenedioic acid, trans-
- (2E)-2-Dodecenedioic acid
- trans-2-Dodecenedioic acid
- (E)-2-Dodecenedioic acid
- trans-Traumatic acid
Work with Traumatic acid
Similar compounds
10-Hydroxy-2-decenoic acid14113-05-463 % similar
10-Hydroxy-2-decenoic acid765-01-563 % similar
Dodec-2-enoic acid32466-54-961 % similar
trans-2-Decenoic acid334-49-661 % similar
2-Nonenoic acid3760-11-061 % similar
trans-2-Decenoic acid72881-27-761 % similar
Elaidic acid112-79-859 % similar
Oleic acid112-80-159 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds