1-Propanol, 3-(alpha-methyl-m-trifluoromethylphenethylamino)-
Basic information
- CAS
22444-69-5- Standard SMILES
CC(Cc1cccc(C(F)(F)F)c1)NCCCO- InChIKey
XFUOIIGOAIUWRS-UHFFFAOYSA-N- Molecular formula
- C13H18F3NO
- Average molar mass
- 261.28 g/mol
- Monoisotopic mass
- 261.13404868
Names & identifiers
- Preferred name
- 1-Propanol, 3-(alpha-methyl-m-trifluoromethylphenethylamino)-
- IUPAC
- 3-[1-[3-(trifluoromethyl)phenyl]propan-2-ylamino]propan-1-ol
- English name
- 3-[[1-Methyl-2-[3-(trifluoromethyl)phenyl]ethyl]amino]-1-propanol
- Molecular weight
- 0
Names & synonyms
22444-69-5BRN 29799343-(alpha-Methyl-m-trifluoromethylphenethylamino)-1-propanol1-Propanol, 3-(alpha-methyl-m-trifluoromethylphenethylamino)-RefChem:2346863-({1-[3-(trifluoromethyl)phenyl]propan-2-yl}amino)propan-1-olDTXSID109451303-[[1-Methyl-2-[3-(trifluoromethyl)phenyl]ethyl]amino]-1-propanol
Database identifiers
- CAS
22444-69-5- PubChem CID
- 211154
- DTXSID
DTXSID10945130- Nikkaji
- J51.001G
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 32.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 233
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Related reactions
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Compound notes
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