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89667-43-6 | 8-Nonenoic acid, 9-phenyl-9-(3-pyridinyl)-, (Z)-
CAS No: 89667-43-6 Catalog No: AG0044KS MDL No:
Product Description
Catalog Number:
AG0044KS
Chemical Name:
8-Nonenoic acid, 9-phenyl-9-(3-pyridinyl)-, (Z)-
CAS Number:
89667-43-6
Molecular Formula:
C20H23NO2
Molecular Weight:
309.4021
IUPAC Name:
9-phenyl-9-pyridin-3-ylnon-8-enoic acid
InChI:
InChI=1S/C20H23NO2/c22-20(23)14-8-3-1-2-7-13-19(17-10-5-4-6-11-17)18-12-9-15-21-16-18/h4-6,9-13,15-16H,1-3,7-8,14H2,(H,22,23)
InChI Key:
PLCQPSFTCFRVIQ-UHFFFAOYSA-N
SMILES:
OC(=O)CCCCCC/C=C(\c1cccnc1)/c1ccccc1
Properties
Complexity:
372
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
309.173g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
309.409g/mol
Monoisotopic Mass:
309.173g/mol
Rotatable Bond Count:
9
Topological Polar Surface Area:
50.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
5.1
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