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alpha-Methylephedrine

HCID 57617
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Basic information

Standard SMILES
CNC(C)C(C)(O)c1ccccc1
InChIKey
SIBUOXVRODUTKZ-UHFFFAOYSA-N
Molecular formula
C11H17NO
Average molar mass
179.26 g/mol
Monoisotopic mass
179.13101417

Names & identifiers

Preferred name
alpha-Methylephedrine
IUPAC
3-(methylamino)-2-phenylbutan-2-ol

Names & synonyms

alpha-MethylephedrineDTXSID001342578

Database identifiers

PubChem CID
57617
DTXSID
DTXSID001342578

Properties

Computed structural properties

XLogP
1.3
Topological polar surface area
32.3 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
2
Rotatable bonds
3
Heavy atoms
13
Formal charge
0
Complexity
154

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Compound notes

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