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1822-51-1 | Pyridine, 4-(chloromethyl)-, hydrochloride (1:1)
CAS No: 1822-51-1 Catalog No: AG0023HC MDL No:MFCD00012826
Product Description
Catalog Number:
AG0023HC
Chemical Name:
Pyridine, 4-(chloromethyl)-, hydrochloride (1:1)
CAS Number:
1822-51-1
Molecular Formula:
C6H7Cl2N
Molecular Weight:
164.0325
MDL Number:
MFCD00012826
IUPAC Name:
4-(chloromethyl)pyridine;hydrochloride
InChI:
InChI=1S/C6H6ClN.ClH/c7-5-6-1-3-8-4-2-6;/h1-4H,5H2;1H
InChI Key:
ZDHKVKPZQKYREU-UHFFFAOYSA-N
SMILES:
ClCc1ccncc1.Cl
EC Number:
217-350-7
NSC Number:
66483
Properties
Complexity:
59.5
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
162.996g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
164.029g/mol
Monoisotopic Mass:
162.996g/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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