CC1=C(N=C(C(=C1Cl)[N+](=O)[O-])Cl)C
CAS: 437384-55-9
Name: 2,4-dichloro-5,6-dimethyl-3-nitropyridine
SMILES: CC1=C(N=C(C(=C1Cl)[N+](=O)[O-])Cl)C

Molecular Processing

Molecular formula
C7H6Cl2N2O2
Molecular weight
221.04
Exact mass
219.9806
XLogP
2.91
TPSA
56.03
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
1
Heavy atoms
13
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.286
Molar refractivity
50.39

Supplementary Information

InChIKey: CEGLXJGCOGYSFS-UHFFFAOYSA-N
Synonyms
437384-55-92,4-dichloro-5,6-dimethyl-3-nitropyridineSCHEMBL843365CEGLXJGCOGYSFS-UHFFFAOYSA-N2,4-Dichloro-5,6-Dimethyl-3-nitro-pyridine
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Involved in 140 reactions→

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