Basic information
- CAS
6273-86-5- Standard SMILES
CCCCNCC(O)c1ccccc1- InChIKey
PWMGSTNAUDACQV-UHFFFAOYSA-N- Molecular formula
- C12H19NO
- Average molar mass
- 193.28 g/mol
- Monoisotopic mass
- 193.14666423
Names & identifiers
- Preferred name
- 2-(Butylamino)-1-phenylethanol
- IUPAC
- 2-(butylamino)-1-phenylethanol
Names & synonyms
2-(butylamino)-1-phenylethanol6273-86-5DTXSID20275495RefChem:253432DTXCID70226932NSC356892-(butylamino)-1-phenylethan-1-ol1-phenyl-2-butylaminoethanolSCHEMBL9307776CHEMBL42767492-(butylamino)-1-phenyl-ethanolNSC39783
Show more names
NSC-35689NSC-39783AKOS002633019AKOS017262163alpha-(Butyaminomethyl)-benzyl alcohol
Database identifiers
- CAS
6273-86-5- PubChem CID
- 46273
- DTXSID
DTXSID20275495- ChEMBL
CHEMBL4276749- Nikkaji
- J1.345.686K
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 32.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 6
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 132
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…