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Home > Pyridines > 116576-81-9
116576-81-9 | 4-Pyridinecarbonyl chloride, 1,2,3,6-tetrahydro-1-methyl-
CAS No: 116576-81-9 Catalog No: AG000CSS MDL No:
Product Description
Catalog Number:
AG000CSS
Chemical Name:
4-Pyridinecarbonyl chloride, 1,2,3,6-tetrahydro-1-methyl-
CAS Number:
116576-81-9
Molecular Formula:
C7H10ClNO
Molecular Weight:
159.6134
IUPAC Name:
1-methyl-3,6-dihydro-2H-pyridine-4-carbonyl chloride
InChI:
InChI=1S/C7H10ClNO/c1-9-4-2-6(3-5-9)7(8)10/h2H,3-5H2,1H3
InChI Key:
SRIVQAUEJOGCPT-UHFFFAOYSA-N
SMILES:
CN1CCC(=CC1)C(=O)Cl
Properties
Complexity:
176
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
159.045g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
159.613g/mol
Monoisotopic Mass:
159.045g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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