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Ephedrine, phosphate (ester), (+)-

HCID 71292
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Basic information

CAS
7234-08-4
Standard SMILES
CN[C@H](C)[C@@H](OP(=O)(O)O)c1ccccc1
InChIKey
NHCPYBTZNTVGGP-PSASIEDQSA-N
Molecular formula
C10H16NO4P
Average molar mass
245.21 g/mol
Monoisotopic mass
245.08169499

Names & identifiers

Preferred name
Ephedrine, phosphate (ester), (+)-
IUPAC
[(1S,2R)-2-(methylamino)-1-phenylpropyl] dihydrogen phosphate

Names & synonyms

Ephedrine, phosphate (ester), (+)-RefChem:1084126D-Ephedrine phosphate (ester)D-alpha-(1-(Methylamino)ethyl)benzyl phosphate

Database identifiers

CAS
7234-08-4
PubChem CID
71292

Properties

Computed structural properties

XLogP
-2
Topological polar surface area
78.8 Ų
Hydrogen bond donors
3
Hydrogen bond acceptors
5
Rotatable bonds
5
Heavy atoms
16
Formal charge
0
Complexity
249

Related reactions

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Compound notes

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