4-(bromomethyl)-1-iodo-2-nitrobenzene

4-(bromomethyl)-1-iodo-2-nitrobenzene

CAS: 940000-52-2

Formula: C7H5BrINO2

SMILES: [O-][N+](=O)C1=C(I)C=CC(CBr)=C1

IUPAC: 4-(bromomethyl)-1-iodo-2-nitrobenzene

InChI: InChI=1S/C7H5BrINO2/c8-4-5-1-2-6(9)7(3-5)10(11)12/h1-3H,4H2

Composition: C (24.59%), H (1.47%), Br (23.37%), I (37.11%), N (4.10%), O (9.36%)

Molar Mass: 341.93

Atom Count: 17

Heavy Atom Count: 12

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	340.85484
Formal Charge	0
FSP3	0.14
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	JEGKXDOEPNYRPZ-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	58.59
Topological Polar Surface Area	43.14
Polarizability	22.43
Ring Count	1
Rotatable Bond Count	2

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95%	<5 Days	940000-52-2		$1,999.00-$2,400.00$1,999.00$2,400.00