6-Cyclopentyl-2,4-xylenol
Basic information
- CAS
52479-94-4- Standard SMILES
Cc1cc(C)c(O)c(C2CCCC2)c1- InChIKey
VRNMLRLXNNNMIN-UHFFFAOYSA-N- Molecular formula
- C13H18O
- Average molar mass
- 190.28 g/mol
- Monoisotopic mass
- 190.13576519
Names & identifiers
- Preferred name
- 6-Cyclopentyl-2,4-xylenol
- IUPAC
- 2-cyclopentyl-4,6-dimethylphenol
- English name
- 6-cyclopentyl-2,4-xylenol
- Molecular formula
- C13H18O
- Molecular weight
- 190.28
Names & synonyms
6-Cyclopentyl-2,4-xylenol52479-94-42-cyclopentyl-4,6-dimethylphenolEINECS 257-946-4SCHEMBL11700915DTXSID80200465VRNMLRLXNNNMIN-UHFFFAOYSA-NDB-325516NS00032514Phenol, 2-cyclopentyl-4,6-dimethyl-
Database identifiers
- CAS
52479-94-4- PubChem CID
- 104208
- DTXSID
DTXSID80200465- EC Number
- 257-946-4
- Nikkaji
- J295.672A
Properties
Computed structural properties
- XLogP
- 4.3
- Topological polar surface area
- 20.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 184
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…