5-bromo-4-chloropyrimidine hydrochloride

5-bromo-4-chloropyrimidine hydrochloride

CAS: 1220039-87-1

Formula: C4H3BrCl2N2

SMILES: Cl.ClC1=NC=NC=C1Br

IUPAC: 5-bromo-4-chloropyrimidine hydrochloride

InChI: InChI=1S/C4H2BrClN2.ClH/c5-3-1-7-2-8-4(3)6;/h1-2H;1H

Composition: C (20.90%), H (1.32%), Br (34.76%), Cl (30.84%), N (12.19%)

Molar Mass: 229.89

Atom Count: 12

Heavy Atom Count: 9

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	227.885667
Formal Charge	0
FSP3	0
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	KZKRABGLKPDEFS-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	36.21
Topological Polar Surface Area	25.78
Polarizability	13.59
Ring Count	1
Rotatable Bond Count	0

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