C1=CN=C(C=C1Cl)CCl
CAS: 10177-21-6
Name: 4-chloro-2-(chloromethyl)pyridine
SMILES: C1=CN=C(C=C1Cl)CCl

Molecular Processing

Molecular formula
C6H5Cl2N
Molecular weight
162.02
Exact mass
160.9799
XLogP
2.47
TPSA
12.89
H-bond donors
0
H-bond acceptors
1
Rotatable bonds
1
Heavy atoms
9
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.167
Molar refractivity
38.8

Supplementary Information

InChIKey: LMYLEZYGXCVCEY-UHFFFAOYSA-N
Synonyme
4-chloro-2-(chloromethyl)pyridine10177-21-6DTXSID20516572RefChem:291441DTXCID20467378862-278-7Pyridine, 4-chloro-2-(chloromethyl)-MFCD077740984-chloropicolinyl chloride4- chloropicolinyl chloride4-chloropicolyl hydrochlorideSCHEMBL5097332-chloromethyl-4-chloropyridine4-Chloro-2-chloromethylpyridineSCHEMBL15741441SCHEMBL297741554-chloro-2-chloromethyl pyridineLMYLEZYGXCVCEY-UHFFFAOYSA-NKAA17721AKOS006346445AB422954-CHLORO-2-CHLOROMETHYL-PYRIDINEBS-19118DA-39718SY069717EN300-89521C13998F8263984-Chloro-2-(chloromethyl)pyridine; 2-Chloromethyl-4-chloro-pyridine; 4-Chloro-2-picolyl chloride
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