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88141-47-3 | Acetamide, N-[4-(1-naphthalenyl)-2-oxo-3-cyclohexen-1-yl]-
CAS No: 88141-47-3 Catalog No: AG004GRH MDL No:
Product Description
Catalog Number:
AG004GRH
Chemical Name:
Acetamide, N-[4-(1-naphthalenyl)-2-oxo-3-cyclohexen-1-yl]-
CAS Number:
88141-47-3
Molecular Formula:
C18H17NO2
Molecular Weight:
279.3331
IUPAC Name:
N-(4-naphthalen-1-yl-2-oxocyclohex-3-en-1-yl)acetamide
InChI:
InChI=1S/C18H17NO2/c1-12(20)19-17-10-9-14(11-18(17)21)16-8-4-6-13-5-2-3-7-15(13)16/h2-8,11,17H,9-10H2,1H3,(H,19,20)
InChI Key:
SUHBLZKSNMIYLA-UHFFFAOYSA-N
SMILES:
CC(=O)NC1CCC(=CC1=O)c1cccc2c1cccc2
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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