Home Carbonyls 5-Isothiazolecarbonylchloride

5-Isothiazolecarbonylchloride

CAS No.:
3683-97-4
Catalog Number:
AG0077WG
Molecular Formula:
C4H2ClNOS
Molecular Weight:
147.5828
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Product Description
Catalog Number:
AG0077WG
Chemical Name:
5-Isothiazolecarbonylchloride
CAS Number:
3683-97-4
Molecular Formula:
C4H2ClNOS
Molecular Weight:
147.5828
MDL Number:
MFCD11227221
IUPAC Name:
1,2-thiazole-5-carbonyl chloride
InChI:
InChI=1S/C4H2ClNOS/c5-4(7)3-1-2-6-8-3/h1-2H
InChI Key:
SPSLWGCXWCZPOY-UHFFFAOYSA-N
SMILES:
ClC(=O)c1ccns1
Properties
Complexity:
108  
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:
1.8  
Properties