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115063-20-2 | Ethanone, 1-(2,3-dihydro-5-benzofuranyl)-2-phenyl-
CAS No: 115063-20-2 Catalog No: AG000FUG MDL No:MFCD01727550
Product Description
Catalog Number:
AG000FUG
Chemical Name:
Ethanone, 1-(2,3-dihydro-5-benzofuranyl)-2-phenyl-
CAS Number:
115063-20-2
Molecular Formula:
C16H14O2
Molecular Weight:
238.2812
MDL Number:
MFCD01727550
IUPAC Name:
1-(2,3-dihydro-1-benzofuran-5-yl)-2-phenylethanone
InChI:
InChI=1S/C16H14O2/c17-15(10-12-4-2-1-3-5-12)13-6-7-16-14(11-13)8-9-18-16/h1-7,11H,8-10H2
InChI Key:
BCAPOOKCRYTVGK-UHFFFAOYSA-N
SMILES:
O=C(c1ccc2c(c1)CCO2)Cc1ccccc1
Properties
Complexity:
294
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
238.099g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
238.286g/mol
Monoisotopic Mass:
238.099g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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