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2-(4-chlorophenyl)pyridine-3-carbaldehyde

2-(4-chlorophenyl)pyridine-3-carbaldehyde

CAS: 885950-19-6

Formula: C12H8ClNO

SMILES: ClC1=CC=C(C=C1)C1=NC=CC=C1C=O

IUPAC: 2-(4-chlorophenyl)pyridine-3-carbaldehyde

InChI: InChI=1S/C12H8ClNO/c13-11-5-3-9(4-6-11)12-10(8-15)2-1-7-14-12/h1-8H

Composition: C (66.22%), H (3.70%), Cl (16.29%), N (6.44%), O (7.35%)

Molar Mass: 217.65

Atom Count: 23

Heavy Atom Count: 15

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 217.0294416
Formal Charge 0
FSP3 0
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 0
InChIKey PJNJVFWVQRIGKX-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 60.05
Topological Polar Surface Area 29.96
Polarizability 24.15
Ring Count 2
Rotatable Bond Count 2

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Purity (%)
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Key Organics Ltd
Purity LeadTime CAS PacketSize UnitPrice
95% <2 Days 885950-19-6 $51.35-$1,347.05$51.35$63.37$86.31$292.79$449.02$1,347.05
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