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124425-84-9 | Pyridine, 5-chloro-2-(chloromethyl)-, hydrochloride (1:1)
CAS No: 124425-84-9 Catalog No: AG000M09 MDL No:MFCD20921510
Product Description
Catalog Number:
AG000M09
Chemical Name:
Pyridine, 5-chloro-2-(chloromethyl)-, hydrochloride (1:1)
CAS Number:
124425-84-9
Molecular Formula:
C6H6Cl3N
Molecular Weight:
198.4775
MDL Number:
MFCD20921510
IUPAC Name:
5-chloro-2-(chloromethyl)pyridine;hydrochloride
InChI:
InChI=1S/C6H5Cl2N.ClH/c7-3-6-2-1-5(8)4-9-6;/h1-2,4H,3H2;1H
InChI Key:
MABOHZPAWTVABD-UHFFFAOYSA-N
SMILES:
ClCc1ccc(cn1)Cl.Cl
Properties
Complexity:
87.1
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
196.957g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
198.471g/mol
Monoisotopic Mass:
196.957g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
12.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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