Registration Dossier

Reference substances

Reference substances

Currently viewing:

General information

Inventory

EC number:
454-140-6
EC name:
-
CAS number:
-
Description:
C3RO

No inventory information available

Reference substance information

IUPAC name:
(1R)-2-(3,4-difluorophenyl)cyclopropan-1-aminium (2R)-2-hydroxy-2-phenylacetate
Synonyms
Names:
2-(3,4-difluorophenyl) cyclopropylamine mandelate
AR-C124896RO
C3RO
Identifier:
CAS number
376608-71-8
Identifier:
IUPAC name
trans-(1R,2S)-2-(3,4-difluorophenyl-cyclopropanaminium (2R)-2-hydroxy-2-phenylethanoate
Identifier:
other: Molecular formula
C17 H17 F2 N O3
Identifier:
other: SMILES notation
[NH3+][C@@H]2C[C@H]2c1cc(F)c(F)cc1.[O-]C(=O)[C@H](O)c1ccccc1
trans-(1R,2S)-2-(3,4-difluorophenyl-cyclopropanaminium (2R)- 2-hydroxy-2-phenylethanoate

CAS information

CAS number:
376608-71-8

Molecular and structural information

Molecular formula:
C9H9F2N*C8H8O3
Molecular weight:
321.33
SMILES notation:
[NH3+][C@@H]2C[C@H]2c1cc(F)c(F)cc1.[O-]C(=O)[C@H](O)c1ccccc1
Structural formula:
Chemical structure