Home Halogens 2-Thiazolecarboxaldehyde, 4-chloro-

2-Thiazolecarboxaldehyde, 4-chloro-

CAS No.:
466686-79-3
Catalog Number:
AG00E6P6
Molecular Formula:
C4H2ClNOS
Molecular Weight:
147.5828
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Product Description
Catalog Number:
AG00E6P6
Chemical Name:
2-Thiazolecarboxaldehyde, 4-chloro-
CAS Number:
466686-79-3
Molecular Formula:
C4H2ClNOS
Molecular Weight:
147.5828
MDL Number:
MFCD18817008
IUPAC Name:
4-chloro-1,3-thiazole-2-carbaldehyde
InChI:
InChI=1S/C4H2ClNOS/c5-3-2-8-4(1-7)6-3/h1-2H
InChI Key:
FIRXGZJYHGJBPL-UHFFFAOYSA-N
SMILES:
Clc1csc(n1)C=O
Properties
Complexity:
100  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
146.955g/mol
Formal Charge:
0
Heavy Atom Count:
8  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
147.576g/mol
Monoisotopic Mass:
146.955g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
58.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Literature
Title Journal
Unique and common metabolites of thiamethoxam, clothianidin, and dinotefuran in mice. Chemical research in toxicology 20061101
Properties