U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry RACEMIC
Molecular Formula C6H11NO2.ClH
Molecular Weight 165.618
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of METHYL DL-PROLINATE HYDROCHLORIDE

SMILES

Cl.COC(=O)C1CCCN1

InChI

InChIKey=HQEIPVHJHZTMDP-UHFFFAOYSA-N
InChI=1S/C6H11NO2.ClH/c1-9-6(8)5-3-2-4-7-5;/h5,7H,2-4H2,1H3;1H

HIDE SMILES / InChI

Molecular Formula C6H11NO2
Molecular Weight 129.157
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Molecular Formula ClH
Molecular Weight 36.461
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

PubMed

PubMed

TitleDatePubMed
Microwave-promoted three-component coupling of aldehyde, alkyne, and amine via C-H activation catalyzed by copper in water.
2004-03-18
The diastereoisomers methyl 5-(S)-[2-(R)/(S)-methoxycarbonyl)-2,3,4,5-tetrahydropyrrol-1-ylcarbonyl]-1-(4-methylphenyl)-4,5-dihydropyrazole-3-carboxylate.
2002-03
Patents
Substance Class Chemical
Created
by admin
on Mon Mar 31 23:36:19 GMT 2025
Edited
by admin
on Mon Mar 31 23:36:19 GMT 2025
Record UNII
X3PYL8G736
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
METHYL DL-PROLINATE HYDROCHLORIDE
Systematic Name English
METHYL PROLINE HYDROCHLORIDE, (RS)-
Preferred Name English
PYRROLIDINE-2-CARBOXYLIC ACID METHYL ESTER HYDROCHLORIDE
Systematic Name English
PROLINE, METHYL ESTER, HYDROCHLORIDE (1:1)
Systematic Name English
METHYL PYRROLIDINE-2-CARBOXYLATE HYDROCHLORIDE
Systematic Name English
DL-PROLINE, METHYL ESTER, HYDROCHLORIDE
Systematic Name English
PROLINE, METHYL ESTER, HYDROCHLORIDE
Systematic Name English
Code System Code Type Description
FDA UNII
X3PYL8G736
Created by admin on Mon Mar 31 23:36:19 GMT 2025 , Edited by admin on Mon Mar 31 23:36:19 GMT 2025
PRIMARY
CAS
79397-50-5
Created by admin on Mon Mar 31 23:36:19 GMT 2025 , Edited by admin on Mon Mar 31 23:36:19 GMT 2025
PRIMARY
PUBCHEM
12223519
Created by admin on Mon Mar 31 23:36:19 GMT 2025 , Edited by admin on Mon Mar 31 23:36:19 GMT 2025
PRIMARY
EPA CompTox
DTXSID10481205
Created by admin on Mon Mar 31 23:36:19 GMT 2025 , Edited by admin on Mon Mar 31 23:36:19 GMT 2025
PRIMARY
Related Record Type Details
ENANTIOMER -> RACEMATE
ENANTIOMER -> RACEMATE