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2-nitro-P-toluidine

2-nitro-P-toluidine

CAS: 89-62-3

Formula: C7H8N2O2

SMILES: CC1=CC(=C(N)C=C1)[N+]([O-])=O

IUPAC: 4-methyl-2-nitroaniline

InChI: InChI=1S/C7H8N2O2/c1-5-2-3-6(8)7(4-5)9(10)11/h2-4H,8H2,1H3

Composition: C (55.26%), H (5.30%), N (18.41%), O (21.03%)

Molar Mass: 152.153

Atom Count: 19

Heavy Atom Count: 11

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 152.058577506
Formal Charge 0
FSP3 0.14
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey DLURHXYXQYMPLT-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 42.12
Topological Polar Surface Area 69.16
Polarizability 15.12
Ring Count 1
Rotatable Bond Count 1

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Purity LeadTime CAS UnitPrice
98% <14 Days 89-62-3 Quote Only