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88628-52-8 | 1(2H)-Naphthalenone, 6-(2-ethoxyethoxy)-3,4-dihydro-
CAS No: 88628-52-8 Catalog No: AG004BRY MDL No:
Product Description
Catalog Number:
AG004BRY
Chemical Name:
1(2H)-Naphthalenone, 6-(2-ethoxyethoxy)-3,4-dihydro-
CAS Number:
88628-52-8
Molecular Formula:
C14H18O3
Molecular Weight:
234.2909
IUPAC Name:
6-(2-ethoxyethoxy)-3,4-dihydro-2H-naphthalen-1-one
InChI:
InChI=1S/C14H18O3/c1-2-16-8-9-17-12-6-7-13-11(10-12)4-3-5-14(13)15/h6-7,10H,2-5,8-9H2,1H3
InChI Key:
ZECAHMYPOBCRSS-UHFFFAOYSA-N
SMILES:
CCOCCOc1ccc2c(c1)CCCC2=O
Properties
Complexity:
252
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
234.126g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
234.295g/mol
Monoisotopic Mass:
234.126g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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