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205985-93-9 | 4-Thiazolidinecarboxylic acid, 2-phenyl-, (4S)-
CAS No: 205985-93-9 Catalog No: AG002AFZ MDL No:
Product Description
Catalog Number:
AG002AFZ
Chemical Name:
4-Thiazolidinecarboxylic acid, 2-phenyl-, (4S)-
CAS Number:
205985-93-9
Molecular Formula:
C10H11NO2S
Molecular Weight:
209.2648
IUPAC Name:
(4S)-2-phenyl-1,3-thiazolidine-4-carboxylic acid
InChI:
InChI=1S/C10H11NO2S/c12-10(13)8-6-14-9(11-8)7-4-2-1-3-5-7/h1-5,8-9,11H,6H2,(H,12,13)/t8-,9?/m1/s1
InChI Key:
AZDYQBFYMBALBY-VEDVMXKPSA-N
SMILES:
OC(=O)[C@H]1CSC(N1)c1ccccc1
Properties
Complexity:
216
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
209.051g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
209.263g/mol
Monoisotopic Mass:
209.051g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
74.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.8
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