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3099-30-7 | Pyridine, 2-(chloromethyl)-6-methyl-, hydrochloride (1:1)
CAS No: 3099-30-7 Catalog No: AG0031UW MDL No:MFCD01691969
Product Description
Catalog Number:
AG0031UW
Chemical Name:
Pyridine, 2-(chloromethyl)-6-methyl-, hydrochloride (1:1)
CAS Number:
3099-30-7
Molecular Formula:
C7H9Cl2N
Molecular Weight:
178.0591
MDL Number:
MFCD01691969
IUPAC Name:
2-(chloromethyl)-6-methylpyridine;hydrochloride
InChI:
InChI=1S/C7H8ClN.ClH/c1-6-3-2-4-7(5-8)9-6;/h2-4H,5H2,1H3;1H
InChI Key:
QFLPSIUFCCCRMI-UHFFFAOYSA-N
SMILES:
ClCc1cccc(n1)C.Cl
EC Number:
221-451-1
NSC Number:
66514
Properties
Complexity:
85
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
177.011g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
178.056g/mol
Monoisotopic Mass:
177.011g/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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