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Ephedrine, phosphate (ester), (-)-

HCID 71293
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Basic information

CAS
7234-07-3
Standard SMILES
CN[C@@H](C)[C@H](OP(=O)(O)O)c1ccccc1
InChIKey
NHCPYBTZNTVGGP-WPRPVWTQSA-N
Molecular formula
C10H16NO4P
Average molar mass
245.21 g/mol
Monoisotopic mass
245.08169499

Names & identifiers

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

Names & synonyms

Ephedrine, phosphate (ester), (-)-RefChem:1084127BRN 2812589L-Ephedrine phosphate (ester)DL-Ephedrine phosphate (ester)L-alpha-(1-(Methylamino)ethyl)benzyl phosphateEphedrine, phosphate (ester), (+-)-DL-alpha-(1-(Methylamino)ethyl)benzyl phosphate7234-09-5

Database identifiers

CAS
7234-07-3、7234-09-5
PubChem CID
71293

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

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Compound notes

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