Basic information
- CAS
121730-40-3- Standard SMILES
CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC(=O)O- InChIKey
ZPSOSNXMSCHPKR-UHFFFAOYSA-N- Molecular formula
- C51H102O2
- Average molar mass
- 747.4 g/mol
- Monoisotopic mass
- 746.78798249
Names & identifiers
- Preferred name
- Henpentacontanoic acid
- IUPAC
- henpentacontanoic acid
Names & synonyms
Henpentacontanoic acidSCHEMBL32680136DTXSID301314368121730-40-3
Database identifiers
- CAS
121730-40-3- PubChem CID
- 85595652
- DTXSID
DTXSID301314368
Properties
Computed structural properties
- XLogP
- 25.3
- Topological polar surface area
- 37.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 49
- Heavy atoms
- 53
- Formal charge
- 0
- Complexity
- 644
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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