methyl 7-bromoimidazo[1,2-a]pyridine-3-carboxylate

methyl 7-bromoimidazo[1,2-a]pyridine-3-carboxylate

CAS: 1313410-86-4

Formula: C9H7BrN2O2

SMILES: COC(=O)C1=CN=C2C=C(Br)C=CN12

IUPAC: methyl 7-bromoimidazo[1,2-a]pyridine-3-carboxylate

InChI: InChI=1S/C9H7BrN2O2/c1-14-9(13)7-5-11-8-4-6(10)2-3-12(7)8/h2-5H,1H3

Composition: C (42.38%), H (2.77%), Br (31.33%), N (10.98%), O (12.54%)

Molar Mass: 255.071

Atom Count: 21

Heavy Atom Count: 14

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	253.96909
Formal Charge	0
FSP3	0.11
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	FITANCORDURZOD-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	55.46
Topological Polar Surface Area	43.6
Polarizability	20.67
Ring Count	2
Rotatable Bond Count	2

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