Sodium abietate
Properties
- Molecular formula
- C20H29NaO2
- Molar mass
- 324.44 g/mol
- Exact mass
- 324.2065 Da
- Melting point
- 300 °C (decomposes)
- logP
- 4.83Crippen estimate
- Polar surface area
- 37.3 Ų
- H-bond donors / acceptors
- 1 / 1
- Rotatable bonds
- 2
- Stereocentres
- R, R, R, Rin SMILES atom order
Hazards
No GHS classification is on file for this compound. That is not evidence that it is harmless.
Identifiers
CAS number
14351-66-7SMILES
CC(C)C1=CC2=CC[C@H]3[C@](C)(C([O-])=O)CCC[C@]3(C)[C@H]2CC1.[Na+]InChI
The InChI we hold for this record describes the parent acid and the metal separately rather than the salt above, so it is not shown here.
Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
5 names
- 1-Phenanthrenecarboxylic acid, 1,2,3,4,4a,4b,5,6,10,10a-decahydro-1,4a-dimethyl-7-(1-methylethyl)-, sodium salt (1:1), (1R,4aR,4bR,10aR)-
- Podocarpa-7,13-dien-15-oic acid, 13-isopropyl-, sodium salt
- 1-Phenanthrenecarboxylic acid, 1,2,3,4,4a,4b,5,6,10,10a-decahydro-1,4a-dimethyl-7-(1-methylethyl)-, sodium salt, [1R-(1α,4aβ,4bα,10aα)]-
- 1-Phenanthrenecarboxylic acid, 1,2,3,4,4a,4b,5,6,10,10a-decahydro-1,4a-dimethyl-7-(1-methylethyl)-, sodium salt, (1R,4aR,4bR,10aR)-
- Abietic acid sodium salt
Work with Sodium abietate
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
Tanimoto similarity of circular fingerprints over the whole catalogue.