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(2S,4R)-4-(4-chlorobenzyl)pyrrolidine-2-carboxylic acid

HCID 178787992
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Basic information

CAS
1049978-20-2
Standard SMILES
O=C(O)[C@@H]1C[C@@H](Cc2ccc(Cl)cc2)CN1
InChIKey
BQRKLZOSDYHVMW-KOLCDFICSA-N
Molecular formula
C12H14ClNO2
Average molar mass
239.7 g/mol

Names & identifiers

Preferred name
(2S,4R)-4-(4-chlorobenzyl)pyrrolidine-2-carboxylic acid
English name
(2S,4R)-4-(4-chlorobenzyl)pyrrolidine-2-carboxylic acid
Molecular formula
C12H14ClNO2
Molecular weight
239.7

Names & synonyms

4-[(4-chlorophenyl)methyl]-L-ProlineL-Proline, 4-[(4-chlorophenyl)methyl]-, (4R)-(2S,4R)-4-(4-chlorobenzyl)pyrrolidine-2-carboxylic acid

Database identifiers

CAS
1049978-20-2

Properties

Physicochemical properties

Boiling point
405.5 · 405.5±40.0 °C(Predicted)
Density
1.28 · 1.280±0.06 g/cm3(Predicted)
pka
2.3 · 2.30±0.40(Predicted)

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