Basic information
- CAS
887587-71-5- Standard SMILES
Cc1cc(O)ccc1NCC1CCC1- InChIKey
SYDFLPLRLNHALX-UHFFFAOYSA-N- Molecular formula
- C12H17NO
- Average molar mass
- 191.27 g/mol
- Monoisotopic mass
- 191.13101417
Names & identifiers
- Preferred name
- 4-[(Cyclobutylmethyl)amino]-3-methylphenol
- IUPAC
- 4-(cyclobutylmethylamino)-3-methylphenol
- English name
- 4-[(Cyclobutylmethyl)-amino]-3-methyl-phenol
- Molecular formula
- C12H17NO
- Molecular weight
- 191.27
Names & synonyms
887587-71-54-[(Cyclobutylmethyl)amino]-3-methylphenol4-(cyclobutylmethylamino)-3-methylphenolDTXSID50695349AKOS0062868974-[(Cyclobutylmethyl)-amino]-3-methyl-phenol
Database identifiers
- CAS
887587-71-5- PubChem CID
- 53404252
- DTXSID
DTXSID50695349
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 32.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 179
Chemistry & industry
Suppliers1 total
BETAPHARMA[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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