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101952-83-4 | 3-Pyridinecarboxylic acid, 1,6-hexanediyl ester (9CI)
CAS No: 101952-83-4 Catalog No: AG00062J MDL No:
Product Description
Catalog Number:
AG00062J
Chemical Name:
3-Pyridinecarboxylic acid, 1,6-hexanediyl ester (9CI)
CAS Number:
101952-83-4
IUPAC Name:
6-(pyridine-3-carbonyloxy)hexyl pyridine-3-carboxylate
InChI:
InChI=1S/C18H20N2O4/c21-17(15-7-5-9-19-13-15)23-11-3-1-2-4-12-24-18(22)16-8-6-10-20-14-16/h5-10,13-14H,1-4,11-12H2
InChI Key:
OBKMIDVZRUPSJJ-UHFFFAOYSA-N
Properties
Complexity:
353
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
328.142g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
328.368g/mol
Monoisotopic Mass:
328.142g/mol
Rotatable Bond Count:
11
Topological Polar Surface Area:
78.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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