1-(bromomethyl)-3-chloro-2-nitrobenzene

1-(bromomethyl)-3-chloro-2-nitrobenzene

CAS: 56433-00-2

Formula: C7H5BrClNO2

SMILES: ClC1=C(C(CBr)=CC=C1)N(=O)=O

IUPAC: 1-(bromomethyl)-3-chloro-2-nitrobenzene

InChI: InChI=1S/C7H5BrClNO2/c8-4-5-2-1-3-6(9)7(5)10(11)12/h1-3H,4H2

Composition: C (33.57%), H (2.01%), Br (31.90%), Cl (14.15%), N (5.59%), O (12.77%)

Molar Mass: 250.48

Atom Count: 17

Heavy Atom Count: 12

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	248.919219
Formal Charge	0
FSP3	0.14
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	AQAIAXUOYCTOOS-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	51.04
Topological Polar Surface Area	45.82
Polarizability	18.92
Ring Count	1
Rotatable Bond Count	2

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Purity	LeadTime	CAS	PacketSize	UnitPrice
95%	<5 Days	56433-00-2		$80.70-$230.76$80.70$107.19$230.76