2-bromo-4-ethoxy-1-nitrobenzene

2-bromo-4-ethoxy-1-nitrobenzene

CAS: 57279-69-3

Formula: C8H8BrNO3

SMILES: CCOC1=CC=C(C(Br)=C1)[N+]([O-])=O

IUPAC: 2-bromo-4-ethoxy-1-nitrobenzene

InChI: InChI=1S/C8H8BrNO3/c1-2-13-6-3-4-8(10(11)12)7(9)5-6/h3-5H,2H2,1H3

Composition: C (39.05%), H (3.28%), Br (32.47%), N (5.69%), O (19.51%)

Molar Mass: 246.06

Atom Count: 21

Heavy Atom Count: 13

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	244.968756
Formal Charge	0
FSP3	0.25
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
InChIKey	MQRFWCCICSGULX-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	51.21
Topological Polar Surface Area	52.37
Polarizability	19.55
Ring Count	1
Rotatable Bond Count	3

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Purity	LeadTime	CAS	PacketSize	UnitPrice
97%	<2 Days	57279-69-3		$150.65-$2,748.50$150.65$187.45$258.75$401.35$687.70$2,748.50