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89257-47-6

89257-47-6 | Carbamic acid, (4-thiazolylcarbonyl)-, methyl ester

CAS No: 89257-47-6 Catalog No: AG0087X3 MDL No:

Product Description

Catalog Number:
AG0087X3
Chemical Name:
Carbamic acid, (4-thiazolylcarbonyl)-, methyl ester
CAS Number:
89257-47-6
Molecular Formula:
C6H6N2O3S
Molecular Weight:
186.1884
IUPAC Name:
methyl N-(1,3-thiazole-4-carbonyl)carbamate
InChI:
InChI=1S/C6H6N2O3S/c1-11-6(10)8-5(9)4-2-12-3-7-4/h2-3H,1H3,(H,8,9,10)
InChI Key:
DMSDONDPAUYNML-UHFFFAOYSA-N
SMILES:
COC(=O)NC(=O)c1cscn1

Properties

Complexity:
197  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
186.01g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
186.185g/mol
Monoisotopic Mass:
186.01g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
96.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7  

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