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88141-46-2 | Acetamide, N-[4-(2-naphthalenyl)-2-oxo-3-cyclohexen-1-yl]-
CAS No: 88141-46-2 Catalog No: AG004GRI MDL No:
Product Description
Catalog Number:
AG004GRI
Chemical Name:
Acetamide, N-[4-(2-naphthalenyl)-2-oxo-3-cyclohexen-1-yl]-
CAS Number:
88141-46-2
Molecular Formula:
C18H17NO2
Molecular Weight:
279.3331
IUPAC Name:
N-(4-naphthalen-2-yl-2-oxocyclohex-3-en-1-yl)acetamide
InChI:
InChI=1S/C18H17NO2/c1-12(20)19-17-9-8-16(11-18(17)21)15-7-6-13-4-2-3-5-14(13)10-15/h2-7,10-11,17H,8-9H2,1H3,(H,19,20)
InChI Key:
QTYNEBOIDMHNAO-UHFFFAOYSA-N
SMILES:
CC(=O)NC1CCC(=CC1=O)c1ccc2c(c1)cccc2
Properties
Complexity:
454
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
279.126g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
279.339g/mol
Monoisotopic Mass:
279.126g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
46.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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