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13117-17-4 | 4-Pyridinecarboxylic acid, 2-cyclooctylidenehydrazide
CAS No: 13117-17-4 Catalog No: AG000VNT MDL No:
Product Description
Catalog Number:
AG000VNT
Chemical Name:
4-Pyridinecarboxylic acid, 2-cyclooctylidenehydrazide
CAS Number:
13117-17-4
Molecular Formula:
C14H19N3O
Molecular Weight:
245.3202
IUPAC Name:
N-(cyclooctylideneamino)pyridine-4-carboxamide
InChI:
InChI=1S/C14H19N3O/c18-14(12-8-10-15-11-9-12)17-16-13-6-4-2-1-3-5-7-13/h8-11H,1-7H2,(H,17,18)
InChI Key:
FLUAKETWIMTOQB-UHFFFAOYSA-N
SMILES:
O=C(c1ccncc1)NN=C1CCCCCCC1
Properties
Complexity:
285
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
245.153g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
245.326g/mol
Monoisotopic Mass:
245.153g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
54.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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