methyl 2,5-dibromopyridine-4-carboxylate

methyl 2,5-dibromopyridine-4-carboxylate

CAS: 1214378-73-0

Formula: C7H5Br2NO2

SMILES: COC(=O)C1=CC(Br)=NC=C1Br

IUPAC: methyl 2,5-dibromopyridine-4-carboxylate

InChI: InChI=1S/C7H5Br2NO2/c1-12-7(11)4-2-6(9)10-3-5(4)8/h2-3H,1H3

Composition: C (28.51%), H (1.71%), Br (54.19%), N (4.75%), O (10.85%)

Molar Mass: 294.93

Atom Count: 17

Heavy Atom Count: 12

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	292.868704
Formal Charge	0
FSP3	0.14
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	DJUYQRYTXYEWHW-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	52.01
Topological Polar Surface Area	39.19
Polarizability	20.02
Ring Count	1
Rotatable Bond Count	2

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95%	<6 Days	1214378-73-0		$141.45-$2,336.80$141.45$187.45$250.70$435.85$600.30$1,090.20$1,764.10$2,336.80