Home Other Building Blocks 4-phenyl-1lambda6,2-thiazolidine-1,1-dione

4-phenyl-1lambda6,2-thiazolidine-1,1-dione

CAS No.:
320393-23-5
Catalog Number:
AG01BAWI
Molecular Formula:
C9H11NO2S
Molecular Weight:
197.2541
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Product Description
Catalog Number:
AG01BAWI
Chemical Name:
4-phenyl-1lambda6,2-thiazolidine-1,1-dione
CAS Number:
320393-23-5
Molecular Formula:
C9H11NO2S
Molecular Weight:
197.2541
MDL Number:
MFCD20483769
IUPAC Name:
4-phenyl-1,2-thiazolidine 1,1-dioxide
InChI:
InChI=1S/C9H11NO2S/c11-13(12)7-9(6-10-13)8-4-2-1-3-5-8/h1-5,9-10H,6-7H2
InChI Key:
CAGITIWEIXFGFH-UHFFFAOYSA-N
SMILES:
O=S1(=O)NCC(C1)c1ccccc1
Properties
Complexity:
262  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
197.051g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
197.252g/mol
Monoisotopic Mass:
197.051g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
54.6A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9  
Properties