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N-(3-acetylphenyl)-2-cyanoacetamide

N-(3-acetylphenyl)-2-cyanoacetamide

CAS: 540532-62-5

Formula: C11H10N2O2

SMILES: CC(=O)C1=CC=CC(NC(=O)CC#N)=C1

IUPAC: N-(3-acetylphenyl)-2-cyanoacetamide

InChI: InChI=1S/C11H10N2O2/c1-8(14)9-3-2-4-10(7-9)13-11(15)5-6-12/h2-4,7H,5H2,1H3,(H,13,15)

Composition: C (65.34%), H (4.98%), N (13.85%), O (15.82%)

Molar Mass: 202.213

Atom Count: 25

Heavy Atom Count: 15

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 202.07422757
Formal Charge 0
FSP3 0.18
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey LAFYQDRMYJMVTJ-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 56.65
Topological Polar Surface Area 69.96
Polarizability 20.64
Ring Count 1
Rotatable Bond Count 3

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95% <2 Days 540532-62-5 $101.60$101.60
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