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1214328-96-7 | Methyl 3-bromo-6-chloropicolinate
CAS No: 1214328-96-7 Catalog No: AG0014SM MDL No:MFCD11976777
Product Description
Catalog Number:
AG0014SM
Chemical Name:
Methyl 3-bromo-6-chloropicolinate
CAS Number:
1214328-96-7
Molecular Formula:
C7H5BrClNO2
Molecular Weight:
250.4771
MDL Number:
MFCD11976777
IUPAC Name:
methyl 3-bromo-6-chloropyridine-2-carboxylate
InChI:
InChI=1S/C7H5BrClNO2/c1-12-7(11)6-4(8)2-3-5(9)10-6/h2-3H,1H3
InChI Key:
APCPBNNLVCVDPL-UHFFFAOYSA-N
SMILES:
COC(=O)c1nc(Cl)ccc1Br
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:
2.7
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