Heptatetracontanoic acid
Basic information
- CAS
121730-37-8- Standard SMILES
CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC(=O)O- InChIKey
LQAZSTJBYJGQGZ-UHFFFAOYSA-N- Molecular formula
- C47H94O2
- Average molar mass
- 691.2 g/mol
- Monoisotopic mass
- 690.72538224
Names & identifiers
- Preferred name
- Heptatetracontanoic acid
- IUPAC
- heptatetracontanoic acid
Names & synonyms
Heptatetracontanoic acidDTXSID401313375121730-37-8
Database identifiers
- CAS
121730-37-8- PubChem CID
- 85595647
- DTXSID
DTXSID401313375
Properties
Computed structural properties
- XLogP
- 23.2
- Topological polar surface area
- 37.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 45
- Heavy atoms
- 49
- Formal charge
- 0
- Complexity
- 587
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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