Basic information
- CAS
63918-85-4- Standard SMILES
CC(Cc1ccccc1)NCCO- InChIKey
KQERCLGZXVLCKZ-UHFFFAOYSA-N- Molecular formula
- C11H17NO
- Average molar mass
- 179.26 g/mol
- Monoisotopic mass
- 179.13101417
Names & identifiers
- Preferred name
- Ethanol, 2-(alpha-methylphenethyl)amino-
- IUPAC
- 2-(1-phenylpropan-2-ylamino)ethanol
- English name
- 2-(α-Methylphenethyl)aminoethanol
- Molecular formula
- C11H17NO
- Molecular weight
- 179.26
Names & synonyms
2-(alpha-Methylphenethyl)aminoethanolBRN 324992463918-85-4alpha-Phenyl-beta-oxyethylaminopropane1-Phenyl-2-(beta-hydroxyethyl)aminopropaneETHANOL, 2-(alpha-METHYLPHENETHYL)AMINO-1-Phenyl-2-beta-oxy-aethyl-amino-propan [German]1-Phenyl-2-beta-oxy-aethyl-amino-propan4-12-00-02594 (Beilstein Handbook Reference)RefChem:340883amphetamine-ethanol2-[(1-Phenylpropan-2-yl)amino]ethan-1-ol
Show more names
2-(α-Methylphenethyl)aminoethanolEthanol, 2-[(1-methyl-2-phenylethyl)amino]-
SCHEMBL5286748SCHEMBL13751292DTXSID50981138AKOS012310826DB-302020
Database identifiers
- CAS
63918-85-4- PubChem CID
- 45446
- DTXSID
DTXSID50981138- Nikkaji
- J78.156H
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 32.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 121
Physicochemical properties
- Boiling point
- 311.8 °C · 311.8°C (rough estimate)
- Density
- 1.002 · 1.0020 (rough estimate)
- refractive index
- 1.532 · 1.5320 (estimate)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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