7-bromo-4-chloropyrrolo[2,1-f][1,2,4]triazine

7-bromo-4-chloropyrrolo[2,1-f][1,2,4]triazine

CAS: 1269667-51-7

Formula: C6H3BrClN3

SMILES: ClC1=NC=NN2C(Br)=CC=C12

IUPAC: 7-bromo-4-chloropyrrolo[2,1-f][1,2,4]triazine

InChI: InChI=1S/C6H3BrClN3/c7-5-2-1-4-6(8)9-3-10-11(4)5/h1-3H

Composition: C (31.00%), H (1.30%), Br (34.37%), Cl (15.25%), N (18.08%)

Molar Mass: 232.47

Atom Count: 14

Heavy Atom Count: 11

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	230.919888
Formal Charge	0
FSP3	0
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	WHHDFKYGOMDNGN-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	58.07
Topological Polar Surface Area	30.19
Polarizability	18.03
Ring Count	2
Rotatable Bond Count	0

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