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88280-89-1 | 3(2H)-Benzofuranone, 2-cyclohexylidene-6-hydroxy-
CAS No: 88280-89-1 Catalog No: AG004BHI MDL No:
Product Description
Catalog Number:
AG004BHI
Chemical Name:
3(2H)-Benzofuranone, 2-cyclohexylidene-6-hydroxy-
CAS Number:
88280-89-1
Molecular Formula:
C14H14O3
Molecular Weight:
230.2592
IUPAC Name:
2-cyclohexylidene-6-hydroxy-1-benzofuran-3-one
InChI:
InChI=1S/C14H14O3/c15-10-6-7-11-12(8-10)17-14(13(11)16)9-4-2-1-3-5-9/h6-8,15H,1-5H2
InChI Key:
AORXDXVOXDLFST-UHFFFAOYSA-N
SMILES:
Oc1ccc2c(c1)OC(=C1CCCCC1)C2=O
Properties
Complexity:
351
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
230.094g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
230.263g/mol
Monoisotopic Mass:
230.094g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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