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821003-97-8 | 2-Propen-1-one, 3-ethoxy-1-(1-naphthalenyl)-, (2E)-
CAS No: 821003-97-8 Catalog No: AG0051T6 MDL No:
Product Description
Catalog Number:
AG0051T6
Chemical Name:
2-Propen-1-one, 3-ethoxy-1-(1-naphthalenyl)-, (2E)-
CAS Number:
821003-97-8
Molecular Formula:
C15H14O2
Molecular Weight:
226.2705
IUPAC Name:
3-ethoxy-1-naphthalen-1-ylprop-2-en-1-one
InChI:
InChI=1S/C15H14O2/c1-2-17-11-10-15(16)14-9-5-7-12-6-3-4-8-13(12)14/h3-11H,2H2,1H3
InChI Key:
NBTHWWVNEWVCIA-UHFFFAOYSA-N
SMILES:
CCO/C=C/C(=O)c1cccc2c1cccc2
Properties
Complexity:
283
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
226.099g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
226.275g/mol
Monoisotopic Mass:
226.099g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
3.4
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