Home Halogens Methyl 4-broMo-6-chloronicotinate

Methyl 4-broMo-6-chloronicotinate

CAS No.:
1256790-93-8
Catalog Number:
AG009GWS
Molecular Formula:
C7H5BrClNO2
Molecular Weight:
250.4771
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Product Description
Catalog Number:
AG009GWS
Chemical Name:
Methyl 4-broMo-6-chloronicotinate
CAS Number:
1256790-93-8
Molecular Formula:
C7H5BrClNO2
Molecular Weight:
250.4771
MDL Number:
MFCD18257867
IUPAC Name:
methyl 4-bromo-6-chloropyridine-3-carboxylate
InChI:
InChI=1S/C7H5BrClNO2/c1-12-7(11)4-3-10-6(9)2-5(4)8/h2-3H,1H3
InChI Key:
SZKLPBKPIATTIK-UHFFFAOYSA-N
SMILES:
COC(=O)c1cnc(cc1Br)Cl
Properties
Complexity:
179  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
248.919g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
250.476g/mol
Monoisotopic Mass:
248.919g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
39.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  
Properties