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5-chloro-3-methyl-2-nitropyridine

5-chloro-3-methyl-2-nitropyridine

CAS: 1211532-85-2

Formula: C6H5ClN2O2

SMILES: CC1=CC(Cl)=CN=C1[N+]([O-])=O

IUPAC: 5-chloro-3-methyl-2-nitropyridine

InChI: InChI=1S/C6H5ClN2O2/c1-4-2-5(7)3-8-6(4)9(10)11/h2-3H,1H3

Composition: C (41.76%), H (2.92%), Cl (20.54%), N (16.23%), O (18.54%)

Molar Mass: 172.57

Atom Count: 16

Heavy Atom Count: 11

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 172.0039551
Formal Charge 0
FSP3 0.17
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 0
InChIKey JQKDQMHAQKONAB-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 40.38
Topological Polar Surface Area 56.03
Polarizability 15.09
Ring Count 1
Rotatable Bond Count 1

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Key Organics Ltd
Purity LeadTime CAS PacketSize UnitPrice
98% <2 Days 1211532-85-2 $51.35-$1,675.90$51.35$63.37$86.31$127.82$1,675.90
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Purity LeadTime CAS PacketSize UnitPrice
98% <5 Days 1211532-85-2 $26.48-$566.19$26.48$41.61$566.19
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