1,4-diethoxy-2-nitrobenzene

1,4-diethoxy-2-nitrobenzene

CAS: 119-23-3

Formula: C10H13NO4

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

IUPAC: 1,4-diethoxy-2-nitrobenzene

InChI: InChI=1S/C10H13NO4/c1-3-14-8-5-6-10(15-4-2)9(7-8)11(12)13/h5-7H,3-4H2,1-2H3

Composition: C (56.87%), H (6.20%), N (6.63%), O (30.30%)

Molar Mass: 211.217

Atom Count: 28

Heavy Atom Count: 15

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	211.084457903
Formal Charge	0
FSP3	0.4
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
InChIKey	AUCRWWWSFGZHBK-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	54.8
Topological Polar Surface Area	61.6
Polarizability	20.96
Ring Count	1
Rotatable Bond Count	5

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