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2-amino-4-acetamidobenzoic acid

2-amino-4-acetamidobenzoic acid

CAS: 43134-76-5

Formula: C9H10N2O3

SMILES: CC(=O)NC1=CC(N)=C(C=C1)C(O)=O

IUPAC: 2-amino-4-acetamidobenzoic acid

InChI: InChI=1S/C9H10N2O3/c1-5(12)11-6-2-3-7(9(13)14)8(10)4-6/h2-4H,10H2,1H3,(H,11,12)(H,13,14)

Composition: C (55.67%), H (5.19%), N (14.43%), O (24.72%)

Molar Mass: 194.19

Atom Count: 24

Heavy Atom Count: 14

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 194.06914219
Formal Charge 0
FSP3 0.11
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 3
InChIKey IFQWBWVICSDDSO-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 52.88
Topological Polar Surface Area 92.42
Polarizability 18.74
Ring Count 1
Rotatable Bond Count 2

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Purity LeadTime CAS PacketSize UnitPrice
95% <2 Days 43134-76-5 $201.07-$329.41$201.07$329.41
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