2-ethyl-4-nitroaniline

2-ethyl-4-nitroaniline

CAS: 6853-29-8

Formula: C8H10N2O2

SMILES: CCC1=CC(=CC=C1N)[N+]([O-])=O

IUPAC: 2-ethyl-4-nitroaniline

InChI: InChI=1S/C8H10N2O2/c1-2-6-5-7(10(11)12)3-4-8(6)9/h3-5H,2,9H2,1H3

Composition: C (57.82%), H (6.07%), N (16.86%), O (19.26%)

Molar Mass: 166.18

Atom Count: 22

Heavy Atom Count: 12

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	166.07422757
Formal Charge	0
FSP3	0.25
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	DCOPKZQDPBRDJY-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	46.72
Topological Polar Surface Area	69.16
Polarizability	16.95
Ring Count	1
Rotatable Bond Count	2

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