2-Biphenylethylamine, N-isopropyl-5-methoxy-, hydrochloride
Basic information
- CAS
15286-44-9- Standard SMILES
COc1ccc(CC[NH2+]C(C)C)c(-c2ccccc2)c1.[Cl-]- InChIKey
RLQHINDVQZJVSZ-UHFFFAOYSA-N- Molecular formula
- C18H24ClNO
- Average molar mass
- 305.8 g/mol
- Monoisotopic mass
- 305.1546421
Names & identifiers
- Preferred name
- 2-Biphenylethylamine, N-isopropyl-5-methoxy-, hydrochloride
- IUPAC
- 2-(4-methoxy-2-phenylphenyl)ethyl-propan-2-ylazanium chloride
Names & synonyms
N-Isopropyl-5-methoxy-2-biphenylethylamine hydrochloride2-BIPHENYLETHYLAMINE, N-ISOPROPYL-5-METHOXY-, HYDROCHLORIDE15286-44-9RefChem:256660
Database identifiers
- CAS
15286-44-9- PubChem CID
- 27181
Properties
Computed structural properties
- Topological polar surface area
- 25.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 6
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 260
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Compound notes
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