Home Halogens Methyl 4-chlorothiazole-5-carboxylate

Methyl 4-chlorothiazole-5-carboxylate

CAS No.:
1015591-57-7
Catalog Number:
AG00H9HW
Molecular Formula:
C5H4ClNO2S
Molecular Weight:
177.6088
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Product Description
Catalog Number:
AG00H9HW
Chemical Name:
Methyl 4-chlorothiazole-5-carboxylate
CAS Number:
1015591-57-7
Molecular Formula:
C5H4ClNO2S
Molecular Weight:
177.6088
MDL Number:
MFCD10478283
IUPAC Name:
methyl 4-chloro-1,3-thiazole-5-carboxylate
InChI:
InChI=1S/C5H4ClNO2S/c1-9-5(8)3-4(6)7-2-10-3/h2H,1H3
InChI Key:
CFFMCXJJYDGJCF-UHFFFAOYSA-N
SMILES:
COC(=O)c1scnc1Cl
Properties
Complexity:
144  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
176.965g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
177.602g/mol
Monoisotopic Mass:
176.965g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
67.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  
Properties