5-bromo-2,4-dimethoxypyrimidine

5-bromo-2,4-dimethoxypyrimidine

CAS: 56686-16-9

Formula: C6H7BrN2O2

SMILES: COC1=NC=C(Br)C(OC)=N1

IUPAC: 5-bromo-2,4-dimethoxypyrimidine

InChI: InChI=1S/C6H7BrN2O2/c1-10-5-4(7)3-8-6(9-5)11-2/h3H,1-2H3

Composition: C (32.90%), H (3.22%), Br (36.48%), N (12.79%), O (14.61%)

Molar Mass: 219.038

Atom Count: 18

Heavy Atom Count: 11

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	217.96909
Formal Charge	0
FSP3	0.33
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
InChIKey	QEZIMQMMEGPYTR-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	43.53
Topological Polar Surface Area	44.24
Polarizability	16.66
Ring Count	1
Rotatable Bond Count	2

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