3-(phenylthiocarbamoylamino)propanoic acid

Modify Date: 2025-08-25 20:31:46

3-(phenylthiocarbamoylamino)propanoic acid Structure
3-(phenylthiocarbamoylamino)propanoic acid structure
Common Name 3-(phenylthiocarbamoylamino)propanoic acid
CAS Number 5540-73-8 Molecular Weight 224.27900
Density 1.344g/cm3 Boiling Point 394.9ºC at 760 mmHg
Molecular Formula C10H12N2O2S Melting Point N/A
MSDS N/A Flash Point 192.6ºC

 Names

Name 3-(phenylcarbamothioylamino)propanoic acid
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.344g/cm3
Boiling Point 394.9ºC at 760 mmHg
Molecular Formula C10H12N2O2S
Molecular Weight 224.27900
Flash Point 192.6ºC
Exact Mass 224.06200
PSA 93.45000
LogP 1.91160
Index of Refraction 1.668
InChIKey NMBWTDIFSHKDJO-UHFFFAOYSA-N
SMILES O=C(O)CCNC(=S)Nc1ccccc1

 Synthetic Route

~99%

3-(phenylthiocarbamoylamino)propanoic acid Structure

3-(phenylthioca...

CAS#:5540-73-8

Literature: Caujolle, R; Payard, M; Loiseau, PR; Amarouch, H; Linas, MD; et al. European Journal of Medicinal Chemistry, 1991 , vol. 26, # 7 p. 723 - 727

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3-(phenylthiocarbamoylamino)propanoic acid Structure

3-(phenylthioca...

CAS#:5540-73-8

Literature: Garmaise et al. Journal of the American Chemical Society, 1958 , vol. 80, p. 3332

~%

3-(phenylthiocarbamoylamino)propanoic acid Structure

3-(phenylthioca...

CAS#:5540-73-8

Literature: Rao,Y.R. Indian Journal of Chemistry, 1969 , vol. 7, p. 772 - 776

~%

3-(phenylthiocarbamoylamino)propanoic acid Structure

3-(phenylthioca...

CAS#:5540-73-8

Literature: Rao,Y.R. Indian Journal of Chemistry, 1969 , vol. 7, p. 772 - 776

~%

3-(phenylthiocarbamoylamino)propanoic acid Structure

3-(phenylthioca...

CAS#:5540-73-8

Literature: Rao,Y.R. Indian Journal of Chemistry, 1969 , vol. 7, p. 772 - 776

 Synonyms

1-Phenyl-3-carboxyaethyl-thioharnstoff
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