12-(4-Methylphenyl)dodecanoic acid
Basic information
- CAS
23293-68-7- Standard SMILES
Cc1ccc(CCCCCCCCCCCC(=O)O)cc1- InChIKey
AIPKSBIXXCQYOQ-UHFFFAOYSA-N- Molecular formula
- C19H30O2
- Average molar mass
- 290.4 g/mol
- Monoisotopic mass
- 290.2245802
Names & identifiers
- Preferred name
- 12-(4-Methylphenyl)dodecanoic acid
- IUPAC
- 12-(4-methylphenyl)dodecanoic acid
Names & synonyms
12-(4-methylphenyl)dodecanoic acid23293-68-7NSC132294SCHEMBL4189855DTXSID80299718HTS24980STL443584AKOS001600538NSC-132294NCGC00341525-01AB01332455-02
Database identifiers
- CAS
23293-68-7- PubChem CID
- 280549
- DTXSID
DTXSID80299718
Properties
Computed structural properties
- XLogP
- 6.6
- Topological polar surface area
- 37.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 12
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 254
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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