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6,8-dimethyl-7-(3-phenylprop-2-en-1-yl)-[1,2,4]triazolo[4,3-b]pyridazine

6,8-dimethyl-7-(3-phenylprop-2-en-1-yl)-[1,2,4]triazolo[4,3-b]pyridazine

CAS: 866137-57-7

Formula: C16H16N4

SMILES: CC1=NN2C=NN=C2C(C)=C1CC=CC1=CC=CC=C1

IUPAC: 6,8-dimethyl-7-(3-phenylprop-2-en-1-yl)-[1,2,4]triazolo[4,3-b]pyridazine

InChI: InChI=1S/C16H16N4/c1-12-15(10-6-9-14-7-4-3-5-8-14)13(2)19-20-11-17-18-16(12)20/h3-9,11H,10H2,1-2H3

Composition: C (72.70%), H (6.10%), N (21.20%)

Molar Mass: 264.332

Atom Count: 36

Heavy Atom Count: 20

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 0
Exact Mass 264.137496531
Formal Charge 0
FSP3 0.19
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 0
InChIKey GYLZHQFHVTWNLJ-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 93.68
Topological Polar Surface Area 43.08
Polarizability 29.92
Ring Count 3
Rotatable Bond Count 3

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Purity LeadTime CAS PacketSize UnitPrice
90% <2 Days 866137-57-7 $51.35-$86.31$51.35$63.37$86.31
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