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114319-42-5 | 3-Pyridinecarbonyl chloride, 2-chloro-4,6-dimethyl-
CAS No: 114319-42-5 Catalog No: AG000B2N MDL No:
Product Description
Catalog Number:
AG000B2N
Chemical Name:
3-Pyridinecarbonyl chloride, 2-chloro-4,6-dimethyl-
CAS Number:
114319-42-5
Molecular Formula:
C8H7Cl2NO
Molecular Weight:
204.0533
IUPAC Name:
2-chloro-4,6-dimethylpyridine-3-carbonyl chloride
InChI:
InChI=1S/C8H7Cl2NO/c1-4-3-5(2)11-7(9)6(4)8(10)12/h3H,1-2H3
InChI Key:
SJWSFNUCYJEBAT-UHFFFAOYSA-N
SMILES:
Cc1cc(C)c(c(n1)Cl)C(=O)Cl
Properties
Complexity:
186
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
202.99g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
204.05g/mol
Monoisotopic Mass:
202.99g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
30A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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