1-(3-sulfanylpropanoyl)pyrrolidine-2-carboxylic acid

Modify Date: 2025-09-09 11:08:33

1-(3-sulfanylpropanoyl)pyrrolidine-2-carboxylic acid Structure
1-(3-sulfanylpropanoyl)pyrrolidine-2-carboxylic acid structure
Common Name 1-(3-sulfanylpropanoyl)pyrrolidine-2-carboxylic acid
CAS Number 63250-31-7 Molecular Weight 203.25900
Density 1.321g/cm3 Boiling Point 431.1ºC at 760 mmHg
Molecular Formula C8H13NO3S Melting Point N/A
MSDS N/A Flash Point 214.5ºC

 Names

Name 1-(3-sulfanylpropanoyl)pyrrolidine-2-carboxylic acid
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.321g/cm3
Boiling Point 431.1ºC at 760 mmHg
Molecular Formula C8H13NO3S
Molecular Weight 203.25900
Flash Point 214.5ºC
Exact Mass 203.06200
PSA 96.41000
LogP 0.31980
Index of Refraction 1.561
InChIKey HYIXVZHJZDSDBA-LURJTMIESA-N
SMILES O=C(O)C1CCCN1C(=O)CCS

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
TW3677000
CHEMICAL NAME :
L-Proline, 1-(3-mercapto-1-oxopropyl)-
CAS REGISTRY NUMBER :
63250-31-7
LAST UPDATED :
198909
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C8-H13-N-O3-S
MOLECULAR WEIGHT :
203.28

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
2500 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
PCJOAU Pharmaceutical Chemistry Journal (English Translation). Translation of KHFZAN. (Plenum Pub. Corp., 233 Spring St., New York, NY 10013) No.1- 1967- Volume(issue)/page/year: 21,842,1987

 Synthetic Route

~%

1-(3-sulfanylpropanoyl)pyrrolidine-2-carboxylic acid Structure

1-(3-sulfanylpr...

CAS#:63250-31-7

Literature: E. R. Squibb and Sons, Inc. Patent: US4105776 A1, 1978 ; US 4105776 A Title/Abstract Full Text Show Details E. R. Squibb and Sons, Inc. Patent: US4046889 A1, 1977 ;

 Precursor & DownStream

Precursor  1

DownStream  0

 Synonyms

1-(3-mercaptopropanoyl)-L-proline
3-mercaptopropanesulfonic acid
1-Propanesulfonic acid,3-mercapto
3-Mercapto-1-propanesulfonic acid
3-mercaptopropylsulfonic acid
3-Mercaptopropanesulphonic acid
mercapto propane sulfonic acid
3-mercaptopropanoyl-L-proline
3-mercapto-1-propanesulphonic acid
The content on this webpage is sourced from various professional data sources. If you have any questions or concerns regarding the content, please feel free to contact service1@chemsrc.com.