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133174-25-1 | 5-Benzofuranol, 2,3-dihydro-2-(2-phenylethyl)-
CAS No: 133174-25-1 Catalog No: AG0014DJ MDL No:
Product Description
Catalog Number:
AG0014DJ
Chemical Name:
5-Benzofuranol, 2,3-dihydro-2-(2-phenylethyl)-
CAS Number:
133174-25-1
Molecular Formula:
C16H16O2
Molecular Weight:
240.2970
IUPAC Name:
2-(2-phenylethyl)-2,3-dihydro-1-benzofuran-5-ol
InChI:
InChI=1S/C16H16O2/c17-14-7-9-16-13(10-14)11-15(18-16)8-6-12-4-2-1-3-5-12/h1-5,7,9-10,15,17H,6,8,11H2
InChI Key:
DGHBJOBIMBJGOE-UHFFFAOYSA-N
SMILES:
Oc1ccc2c(c1)CC(O2)CCc1ccccc1
Properties
Complexity:
260
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
240.115g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
240.302g/mol
Monoisotopic Mass:
240.115g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
4
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