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4-amino-3-(methylamino)benzamide

4-amino-3-(methylamino)benzamide

Formula: C8H11N3O

SMILES: CNC1=C(N)C=CC(=C1)C(N)=O

IUPAC: 4-amino-3-(methylamino)benzamide

InChI: InChI=1S/C8H11N3O/c1-11-7-4-5(8(10)12)2-3-6(7)9/h2-4,11H,9H2,1H3,(H2,10,12)

Composition: C (58.17%), H (6.71%), N (25.44%), O (9.68%)

Molar Mass: 165.196

Atom Count: 23

Heavy Atom Count: 12

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 165.090211986
Formal Charge 0
FSP3 0.12
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 3
InChIKey UNUGQHUWVAHKLG-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 50.03
Topological Polar Surface Area 81.14
Polarizability 17.29
Ring Count 1
Rotatable Bond Count 2

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Purity (%)
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Molecule Market Select
Purity LeadTime Formula UnitPrice
98% <10 Days C8H11N3O Quote Only