AG005P1E

72778-00-8 | L-5,5-Dimethylthiazolidine-4-carboxylic acid

AG005P1E

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CAS Number	72778-00-8
Catalog Number	AG005P1E(AGN-PC-0OH6F8)
Chemical Name	L-5,5-Dimethylthiazolidine-4-carboxylic acid
IUPAC Name	(4R)-5,5-dimethyl-1,3-thiazolidine-4-carboxylic acid
InChI	InChI=1S/C6H11NO2S/c1-6(2)4(5(8)9)7-3-10-6/h4,7H,3H2,1-2H3,(H,8,9)/t4-/m1/s1
InChI Key	PMQQFSDIECYOQV-SCSAIBSYSA-N
MDL Number	MFCD00070264
Molecular Formula	C6H11NO2S
Molecular Weight	161.2220
SMILES	O=C([C@H]1NCSC1(C)C)O
Synonyms	72778-00-8, (R)-5,5-Dimethylthiazolidine-4-carboxylic acid, L-5,5-Dimethylthiazolidine-4-carboxylic acid, (4R)-5,5-dimethyl-1,3-thiazolidine-4-carboxylic acid, AC1NWXTG, 3,3-Dimethyl-4-thiaproline, SCHEMBL950964, CHEMBL1229504, CTK2H5856, DTXSID20420827, ZINC5105765, 7293AH, KM1504, MFCD00070264, AKOS006272974, AJ-53104, FT-0667563, 4-Thiazolidinecarboxylic acid, 5,5-dimethyl-, (4R)-, 4-Thiazolidinecarboxylicacid, 5,5-dimethyl-, (4R)-, Maybridge3_004308, C6H11NO2S, CID5715192,

Complexity	158
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Exact Mass	161.051g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	161.219g/mol
Monoisotopic Mass	161.051g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	74.6A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	-1.7

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number