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6-amino-4-(2-chlorophenyl)-3-methyl-2H,4H-pyrano[2,3-c]pyrazole-5-carbonitrile

6-amino-4-(2-chlorophenyl)-3-methyl-2H,4H-pyrano[2,3-c]pyrazole-5-carbonitrile

Formula: C14H11ClN4O

SMILES: CC1=C2C(C3=CC=CC=C3Cl)C(C#N)=C(N)OC2=NN1

IUPAC: 6-amino-4-(2-chlorophenyl)-3-methyl-2H,4H-pyrano[2,3-c]pyrazole-5-carbonitrile

InChI: InChI=1/C14H11ClN4O/c1-7-11-12(8-4-2-3-5-10(8)15)9(6-16)13(17)20-14(11)19-18-7/h2-5,12H,17H2,1H3,(H,18,19)

Composition: C (58.65%), H (3.87%), Cl (12.36%), N (19.54%), O (5.58%)

Molar Mass: 286.72

Atom Count: 31

Heavy Atom Count: 20

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 1
Exact Mass 286.0621387
Formal Charge 0
FSP3 0.14
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 2
InChIKey GPWYRDPTGJYJNL-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 87.04
Topological Polar Surface Area 87.72
Polarizability 28.44
Ring Count 3
Rotatable Bond Count 1

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C14H11ClN4O $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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