5-bromo-2-(dimethoxymethyl)-3-methoxypyridine

5-bromo-2-(dimethoxymethyl)-3-methoxypyridine

CAS: 1138443-86-3

Formula: C9H12BrNO3

SMILES: COC(OC)C1=NC=C(Br)C=C1OC

IUPAC: 5-bromo-2-(dimethoxymethyl)-3-methoxypyridine

InChI: InChI=1S/C9H12BrNO3/c1-12-7-4-6(10)5-11-8(7)9(13-2)14-3/h4-5,9H,1-3H3

Composition: C (41.24%), H (4.61%), Br (30.49%), N (5.34%), O (18.31%)

Molar Mass: 262.103

Atom Count: 26

Heavy Atom Count: 14

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	261.000056
Formal Charge	0
FSP3	0.44
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
InChIKey	YOIJJDCAWUXHRJ-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	54.98
Topological Polar Surface Area	40.58
Polarizability	21.8
Ring Count	1
Rotatable Bond Count	4

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