1,2-dichloro-3,5-dinitrobenzene

1,2-dichloro-3,5-dinitrobenzene

CAS: 2213-80-1

Formula: C6H2Cl2N2O4

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

IUPAC: 1,2-dichloro-3,5-dinitrobenzene

InChI: InChI=1S/C6H2Cl2N2O4/c7-4-1-3(9(11)12)2-5(6(4)8)10(13)14/h1-2H

Composition: C (30.41%), H (0.85%), Cl (29.92%), N (11.82%), O (27.00%)

Molar Mass: 236.99

Atom Count: 16

Heavy Atom Count: 14

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	235.939162
Formal Charge	0
FSP3	0
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
InChIKey	UDZACPYKQWPMBC-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	48.31
Topological Polar Surface Area	86.28
Polarizability	18.28
Ring Count	1
Rotatable Bond Count	2

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