Home Aminos 2-[4-(aminomethyl)phenyl]-1,2-thiazolidine-1,1-dione

2-[4-(aminomethyl)phenyl]-1,2-thiazolidine-1,1-dione

CAS No.:
1016529-85-3
Catalog Number:
AG01ABZI
Molecular Formula:
C10H14N2O2S
Molecular Weight:
226.2954
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Product Description
Catalog Number:
AG01ABZI
Chemical Name:
2-[4-(aminomethyl)phenyl]-1,2-thiazolidine-1,1-dione
CAS Number:
1016529-85-3
Molecular Formula:
C10H14N2O2S
Molecular Weight:
226.2954
MDL Number:
MFCD09805348
IUPAC Name:
[4-(1,1-dioxo-1,2-thiazolidin-2-yl)phenyl]methanamine
InChI:
InChI=1S/C10H14N2O2S/c11-8-9-2-4-10(5-3-9)12-6-1-7-15(12,13)14/h2-5H,1,6-8,11H2
InChI Key:
DEGLQAJTIAVTNY-UHFFFAOYSA-N
SMILES:
NCc1ccc(cc1)N1CCCS1(=O)=O
Properties
Complexity:
302  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
226.078g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
226.294g/mol
Monoisotopic Mass:
226.078g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
71.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1  
Properties