Basic information
- CAS
5457-80-7- Standard SMILES
CCCCNC(C)(C)C(O)c1ccccc1- InChIKey
SITFELSBPZELDY-UHFFFAOYSA-N- Molecular formula
- C14H23NO
- Average molar mass
- 221.34 g/mol
- Monoisotopic mass
- 221.17796436
Names & identifiers
- Preferred name
- 2-(Butylamino)-2-methyl-1-phenylpropan-1-ol
- IUPAC
- 2-(butylamino)-2-methyl-1-phenylpropan-1-ol
Names & synonyms
2-(butylamino)-2-methyl-1-phenylpropan-1-ol5457-80-7NSC23928DTXSID30282034NSC-23928
Database identifiers
- CAS
5457-80-7- PubChem CID
- 229872
- DTXSID
DTXSID30282034
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 32.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 6
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 185
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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