Basic information
- CAS
887587-57-7- Standard SMILES
Cc1cc(O)ccc1NCC1CCCCCC1- InChIKey
VJGPFCZRKYOYJP-UHFFFAOYSA-N- Molecular formula
- C15H23NO
- Average molar mass
- 233.35 g/mol
- Monoisotopic mass
- 233.17796436
Names & identifiers
- Preferred name
- 4-[(Cycloheptylmethyl)amino]-3-methylphenol
- IUPAC
- 4-(cycloheptylmethylamino)-3-methylphenol
- English name
- 4-[(Cycloheptylmethyl)-amino]-3-methyl-phenol
- Molecular formula
- C15H23NO
- Molecular weight
- 233.35
Names & synonyms
4-[(Cycloheptylmethyl)amino]-3-methylphenol887587-57-74-(cycloheptylmethylamino)-3-methylphenolDTXSID60695350AKOS0151515394-[(Cycloheptylmethyl)-amino]-3-methyl-phenolPhenol, 4-[(cycloheptylmethyl)amino]-3-methyl-
Database identifiers
- CAS
887587-57-7- PubChem CID
- 53404253
- DTXSID
DTXSID60695350
Properties
Computed structural properties
- XLogP
- 4.8
- Topological polar surface area
- 32.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 211
Chemistry & industry
Suppliers1 total
BETAPHARMA[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…