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15548-02-4 | Cyclohexanone, 2-ethyl-2-(3-methoxyphenyl)-, oxime
CAS No: 15548-02-4 Catalog No: AG001NXX MDL No:
Product Description
Catalog Number:
AG001NXX
Chemical Name:
Cyclohexanone, 2-ethyl-2-(3-methoxyphenyl)-, oxime
CAS Number:
15548-02-4
Molecular Formula:
C15H21NO2
Molecular Weight:
247.3327
IUPAC Name:
N-[2-ethyl-2-(3-methoxyphenyl)cyclohexylidene]hydroxylamine
InChI:
InChI=1S/C15H21NO2/c1-3-15(10-5-4-9-14(15)16-17)12-7-6-8-13(11-12)18-2/h6-8,11,17H,3-5,9-10H2,1-2H3
InChI Key:
DXQBIKXUBNQJPG-UHFFFAOYSA-N
SMILES:
ON=C1CCCCC1(CC)c1cccc(c1)OC
Properties
Complexity:
303
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
247.157g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
247.338g/mol
Monoisotopic Mass:
247.157g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
41.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
1
XLogP3:
3.6
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