5-bromo-2-fluoro-1-methoxy-3-methylbenzene

5-bromo-2-fluoro-1-methoxy-3-methylbenzene

CAS: 1351668-20-6

Formula: C8H8BrFO

SMILES: COC1=CC(Br)=CC(C)=C1F

IUPAC: 5-bromo-2-fluoro-1-methoxy-3-methylbenzene

InChI: InChI=1S/C8H8BrFO/c1-5-3-6(9)4-7(11-2)8(5)10/h3-4H,1-2H3

Composition: C (43.87%), H (3.68%), Br (36.48%), F (8.67%), O (7.30%)

Molar Mass: 219.053

Atom Count: 19

Heavy Atom Count: 11

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	217.974256
Formal Charge	0
FSP3	0.25
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
InChIKey	BNLXSNQTRFKATL-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	45.4
Topological Polar Surface Area	9.23
Polarizability	17.23
Ring Count	1
Rotatable Bond Count	1

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Purity	LeadTime	CAS	PacketSize	UnitPrice
97%	<2 Days	1351668-20-6		$182.45-$459.94$182.45$182.45$459.94$459.94