Home Halogens ethyl 5-broMo-2-chlorothiazole-4-carboxylate

ethyl 5-broMo-2-chlorothiazole-4-carboxylate

CAS No.:
1125409-85-9
Catalog Number:
AG00940E
Molecular Formula:
C6H5BrClNO2S
Molecular Weight:
270.5314
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Product Description
Catalog Number:
AG00940E
Chemical Name:
ethyl 5-broMo-2-chlorothiazole-4-carboxylate
CAS Number:
1125409-85-9
Molecular Formula:
C6H5BrClNO2S
Molecular Weight:
270.5314
MDL Number:
MFCD16615260
IUPAC Name:
ethyl 5-bromo-2-chloro-1,3-thiazole-4-carboxylate
InChI:
InChI=1S/C6H5BrClNO2S/c1-2-11-5(10)3-4(7)12-6(8)9-3/h2H2,1H3
InChI Key:
IAUOQHXDFFIRLP-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1nc(sc1Br)Cl
Properties
Complexity:
183  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
268.891g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
270.525g/mol
Monoisotopic Mass:
268.891g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
67.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5  
Properties