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158876-83-6 | Pyridine, 3-(chloromethyl)-5-methyl-
CAS No: 158876-83-6 Catalog No: AG001QYU MDL No:MFCD09998368
Product Description
Catalog Number:
AG001QYU
Chemical Name:
Pyridine, 3-(chloromethyl)-5-methyl-
CAS Number:
158876-83-6
Molecular Formula:
C7H8ClN
Molecular Weight:
141.5981
MDL Number:
MFCD09998368
IUPAC Name:
3-(chloromethyl)-5-methylpyridine
InChI:
InChI=1S/C7H8ClN/c1-6-2-7(3-8)5-9-4-6/h2,4-5H,3H2,1H3
InChI Key:
DZZYVVUYEDSKBU-UHFFFAOYSA-N
SMILES:
Cc1cc(CCl)cnc1
Properties
Complexity:
85
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
141.035g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
141.598g/mol
Monoisotopic Mass:
141.035g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
12.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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