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3-chloro-6-phenylpyridazine-4-carbonitrile

3-chloro-6-phenylpyridazine-4-carbonitrile

CAS: 94011-64-0

Formula: C11H6ClN3

SMILES: ClC1=NN=C(C=C1C#N)C1=CC=CC=C1

IUPAC: 3-chloro-6-phenylpyridazine-4-carbonitrile

InChI: InChI=1S/C11H6ClN3/c12-11-9(7-13)6-10(14-15-11)8-4-2-1-3-5-8/h1-6H

Composition: C (61.27%), H (2.80%), Cl (16.44%), N (19.49%)

Molar Mass: 215.64

Atom Count: 21

Heavy Atom Count: 15

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 215.0250249
Formal Charge 0
FSP3 0
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 0
InChIKey NYUXYSKLVIYNMD-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 60.12
Topological Polar Surface Area 49.57
Polarizability 23.29
Ring Count 2
Rotatable Bond Count 1

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Key Organics Ltd
Purity LeadTime CAS PacketSize UnitPrice
95% <2 Days 94011-64-0 $51.35-$86.31$51.35$63.37$75.38$86.31
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