Home Halogens 3-(4-chlorobenzoyl)-1,3-thiazolidine-4-carboxylic acid

3-(4-chlorobenzoyl)-1,3-thiazolidine-4-carboxylic acid

CAS No.:
1042437-09-1
Catalog Number:
AG01AA98
Molecular Formula:
C11H10ClNO3S
Molecular Weight:
271.7200
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Product Description
Catalog Number:
AG01AA98
Chemical Name:
3-(4-chlorobenzoyl)-1,3-thiazolidine-4-carboxylic acid
CAS Number:
1042437-09-1
Molecular Formula:
C11H10ClNO3S
Molecular Weight:
271.7200
MDL Number:
MFCD03015442
IUPAC Name:
3-(4-chlorobenzoyl)-1,3-thiazolidine-4-carboxylic acid
InChI:
InChI=1S/C11H10ClNO3S/c12-8-3-1-7(2-4-8)10(14)13-6-17-5-9(13)11(15)16/h1-4,9H,5-6H2,(H,15,16)
InChI Key:
SUAAPVQQVPKSHG-UHFFFAOYSA-N
SMILES:
O=C(c1ccc(cc1)Cl)N1CSCC1C(=O)O
Properties
Complexity:
318  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
271.007g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
271.715g/mol
Monoisotopic Mass:
271.007g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
82.9A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  
Properties