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114661-95-9 | Ethanone, 1-[1-methoxy-4-(2-propen-1-yloxy)-2-naphthalenyl]-
CAS No: 114661-95-9 Catalog No: AG000EYI MDL No:
Product Description
Catalog Number:
AG000EYI
Chemical Name:
Ethanone, 1-[1-methoxy-4-(2-propen-1-yloxy)-2-naphthalenyl]-
CAS Number:
114661-95-9
Molecular Formula:
C16H16O3
Molecular Weight:
256.2964
IUPAC Name:
1-(1-methoxy-4-prop-2-enoxynaphthalen-2-yl)ethanone
InChI:
InChI=1S/C16H16O3/c1-4-9-19-15-10-14(11(2)17)16(18-3)13-8-6-5-7-12(13)15/h4-8,10H,1,9H2,2-3H3
InChI Key:
KZBUYQGRZMBMDU-UHFFFAOYSA-N
SMILES:
C=CCOc1cc(C(=O)C)c(c2c1cccc2)OC
Properties
Complexity:
326
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
256.11g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
256.301g/mol
Monoisotopic Mass:
256.11g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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