Thiazolidine-2-carboxylic acid - CAS 65126-70-7

Catalog:	BB032635
Product Name:	Thiazolidine-2-carboxylic acid
CAS:	65126-70-7
Synonyms:	1,3-thiazolidine-2-carboxylic acid

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Computed Properties

IUPAC Name:	1,3-thiazolidine-2-carboxylic acid
Description:	Thiazolidine-2-carboxylic acid (CAS# 65126-70-7) is a derivative of thiazolidyne-4-carboxylic acid (thiaproline) (T344205) and can be used as a colouring agent. Futhermore, it may be a physiological substrate for D-amino acid oxidase.
Molecular Weight:	133.17
Molecular Formula:	C4H7NO2S
Canonical SMILES:	C1CSC(N1)C(=O)O
InChI:	InChI=1S/C4H7NO2S/c6-4(7)3-5-1-2-8-3/h3,5H,1-2H2,(H,6,7)
InChI Key:	ULSZVNJBVJWEJE-UHFFFAOYSA-N
Melting Point:	179 ℃
Purity:	95 %
Appearance:	Powder
MDL:	MFCD00068005
LogP:	0.06230

Publication Number	Title	Priority Date
WO-2021210409-A1	Composition containing nucleic acid oligomer	20200414
WO-2021081110-A2	Peptides and use thereof	20191022
WO-2021076703-A1	Compounds and methods for modulating immune-related proteins	20191016
WO-2021076755-A1	An activity-guide map of electrophile-cysteine interactions in primary human immune cells	20191016
WO-2021072167-A1	Compositions and methods for in vivo synthesis of unnatural polypeptides	20191010

PMID	Publication Date	Title	Journal
22799571	20120823	Photoelectron spectra of some antibiotic building blocks: 2-azetidinone and thiazolidine-carboxylic acid	The journal of physical chemistry. A
22373364	20110906	[3 + 2] Cycloaddition reactions of thioisatin with thiazolidine-2-carboxylic acid: a versatile route to new heterocyclic scaffolds	Organic and medicinal chemistry letters
21253822	20110501	L-Proline nutrition and catabolism in Staphylococcus saprophyticus	Antonie van Leeuwenhoek
17912351	20071003	An expanded set of amino acid analogs for the ribosomal translation of unnatural peptides	PloS one
17319745	20070223	The role of mitochondrial DNA mutations in mammalian aging	PLoS genetics

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Related Functional Groups

Thiazolines/Thiazolidines

[101869-79-8]
2-[(2,5-Dichlorophenyl)amino]-1,3-thiazol-4(5H)-one
[553675-18-6]
2-(4-Biphenylylamino)-1,3-thiazol-4(5H)-one
[31061-24-2]
(2,4-Dioxo-1,3-thiazolidin-3-yl)acetic acid
[69570-82-7]
2-(4-Fluorophenyl)-1,3-thiazolidine-4-carboxylic acid
[66625-28-3]
2-(4-Methoxy-phenylamino)-thiazol-4-one
[13238-64-7]
1-(4-Oxo-2-thioxo-1,3-thiazolidin-3-yl)-3-phenylurea

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GHS Hazard Statement:	H302 (97.44%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	106
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	133.01974964
Formal Charge:	0
Heavy Atom Count:	8
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	133.01974964
Rotatable Bond Count:	1
Topological Polar Surface Area:	74.6 Å²
Undefined Atom Stereocenter Count:	1
Undefined Bond Stereocenter Count:	0
XLogP3:	-2.3