Basic information
- CAS
17140-34-0- Standard SMILES
CCCCCCc1c(C)cccc1O- InChIKey
AOKSOKUXKQEENT-UHFFFAOYSA-N- Molecular formula
- C13H20O
- Average molar mass
- 192.3 g/mol
- Monoisotopic mass
- 192.15141526
Names & identifiers
- Preferred name
- 2-Hexyl-M-cresol
- IUPAC
- 2-hexyl-3-methylphenol
Names & synonyms
2-HEXYL-M-CRESOL2-hexyl-3-methylphenol17140-34-0m-Cresol, 2-hexyl-WR5XU06FGKPhenol, 2-hexyl-3-methyl-UNII-WR5XU06FGKSCHEMBL981443orb1986765AKOS040749919T29351Q27292785
Database identifiers
- CAS
17140-34-0- PubChem CID
- 28322
- UNII
- WR5XU06FGK
Properties
Computed structural properties
- XLogP
- 4.9
- Topological polar surface area
- 20.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 5
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 144
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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