4-bromo-2-fluoro-5-methoxybenzaldehyde

4-bromo-2-fluoro-5-methoxybenzaldehyde

CAS: 749931-20-2

Formula: C8H6BrFO2

SMILES: COC1=CC(C=O)=C(F)C=C1Br

IUPAC: 4-bromo-2-fluoro-5-methoxybenzaldehyde

InChI: InChI=1S/C8H6BrFO2/c1-12-8-2-5(4-11)7(10)3-6(8)9/h2-4H,1H3

Composition: C (41.23%), H (2.60%), Br (34.29%), F (8.15%), O (13.73%)

Molar Mass: 233.036

Atom Count: 18

Heavy Atom Count: 12

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	231.953521
Formal Charge	0
FSP3	0.12
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	TWHBNRXZMJJLJO-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	46.94
Topological Polar Surface Area	26.3
Polarizability	17.49
Ring Count	1
Rotatable Bond Count	2

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Purity	LeadTime	CAS	PacketSize	UnitPrice
98%	<5 Days	749931-20-2		$34.05-$70.62$34.05$70.62