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2-Bromo-6-chloro-4-pyridinecarboxylic Acid Methyl Ester

2-Bromo-6-chloro-4-pyridinecarboxylic Acid Methyl Ester - CAS 1206250-22-7

Name: 2-Bromo-6-chloro-4-pyridinecarboxylic Acid Methyl Ester
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB072282
Product Name:	2-Bromo-6-chloro-4-pyridinecarboxylic Acid Methyl Ester
CAS:	1206250-22-7
Synonyms:	methyl 2-bromo-6-chloroisonicotinate; methyl 2-bromo-6-chloropyridine-4-carboxylate; 2-Bromo-6-chloro-4-pyridinecarboxylic Acid Methyl Ester

Technical Data

Computed Properties

IUPAC Name:	methyl 2-bromo-6-chloropyridine-4-carboxylate
Molecular Weight:	250.48
Molecular Formula:	C7H5BrClNO2
Canonical SMILES:	COC(=O)C1=CC(=NC(=C1)Br)Cl
InChI:	InChI=1S/C7H5BrClNO2/c1-12-7(11)4-2-5(8)10-6(9)3-4/h2-3H,1H3
InChI Key:	CZRXZMDYMMNDTB-UHFFFAOYSA-N
References:	Cottet, F., et al. Eur. J. Org. Chem., 327 (2002).

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Related Functional Groups

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Complexity:	179
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	248.91922
Formal Charge:	0
Heavy Atom Count:	12
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	248.91922
Rotatable Bond Count:	2
Topological Polar Surface Area:	39.2Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.7