Basic information
- CAS
887587-61-3- Standard SMILES
Cc1cc(O)ccc1NCC1CCCCC1- InChIKey
TVPISORNNPXVQX-UHFFFAOYSA-N- Molecular formula
- C14H21NO
- Average molar mass
- 219.32 g/mol
- Monoisotopic mass
- 219.16231429
Names & identifiers
- Preferred name
- 4-[(Cyclohexylmethyl)amino]-3-methylphenol
- IUPAC
- 4-(cyclohexylmethylamino)-3-methylphenol
- English name
- 4-[(Cyclohexylmethyl)-amino]-3-methyl-phenol
- Molecular formula
- C14H21NO
- Molecular weight
- 219.32
Names & synonyms
887587-61-34-[(Cyclohexylmethyl)amino]-3-methylphenolDTXSID20695351AKOS0138167124-[(Cyclohexylmethyl)-amino]-3-methyl-phenol
Database identifiers
- CAS
887587-61-3- PubChem CID
- 53404254
- DTXSID
DTXSID20695351
Properties
Computed structural properties
- XLogP
- 4.3
- Topological polar surface area
- 32.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 201
Chemistry & industry
Suppliers1 total
BETAPHARMA[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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