Benzoic acid, 2-decyl-6-hydroxy-
Basic information
- CAS
148529-38-8- Standard SMILES
CCCCCCCCCCc1cccc(O)c1C(=O)O- InChIKey
ZQDLBPGHPAIXKL-UHFFFAOYSA-N- Molecular formula
- C17H26O3
- Average molar mass
- 278.4 g/mol
- Monoisotopic mass
- 278.18819469
Names & identifiers
- Preferred name
- Benzoic acid, 2-decyl-6-hydroxy-
- IUPAC
- 2-decyl-6-hydroxybenzoic acid
Names & synonyms
Benzoic acid, 2-decyl-6-hydroxy-148529-38-8DTXSID80430841RefChem:326858DTXCID503816746-Decylsalicylic AcidCHEMBL4160382-DECYL-6-HYDROXYBENZOIC ACIDSCHEMBL5378937BDBM50469667
Database identifiers
- CAS
148529-38-8- PubChem CID
- 9795646
- DTXSID
DTXSID80430841- ChEMBL
CHEMBL416038
Properties
Computed structural properties
- XLogP
- 6.8
- Topological polar surface area
- 57.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 10
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 265
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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