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263705-60-8 | Ethanone, 1-[6-[1-[[2,6-bis(1-methylethyl)phenyl]imino]ethyl]-2-pyridinyl]-
CAS No: 263705-60-8 Catalog No: AG002SX9 MDL No:
Product Description
Catalog Number:
AG002SX9
Chemical Name:
Ethanone, 1-[6-[1-[[2,6-bis(1-methylethyl)phenyl]imino]ethyl]-2-pyridinyl]-
CAS Number:
263705-60-8
Molecular Formula:
C21H26N2O
Molecular Weight:
322.4439
IUPAC Name:
1-[6-[N-[2,6-di(propan-2-yl)phenyl]-C-methylcarbonimidoyl]pyridin-2-yl]ethanone
InChI:
InChI=1S/C21H26N2O/c1-13(2)17-9-7-10-18(14(3)4)21(17)22-15(5)19-11-8-12-20(23-19)16(6)24/h7-14H,1-6H3
InChI Key:
JHAJUHKMVPSRFB-UHFFFAOYSA-N
SMILES:
CC(=Nc1c(cccc1C(C)C)C(C)C)c1cccc(n1)C(=O)C
Properties
Complexity:
439
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
322.205g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
322.452g/mol
Monoisotopic Mass:
322.205g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
42.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5
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