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114370-58-0 | 5-Benzofuranol, 2,3-dihydro-6-[3-[3-(2-hydroxyethyl)phenyl]-2-propen-1-yl]-
CAS No: 114370-58-0 Catalog No: AG000B62 MDL No:
Product Description
Catalog Number:
AG000B62
Chemical Name:
5-Benzofuranol, 2,3-dihydro-6-[3-[3-(2-hydroxyethyl)phenyl]-2-propen-1-yl]-
CAS Number:
114370-58-0
Molecular Formula:
C19H20O3
Molecular Weight:
296.3603
IUPAC Name:
6-[3-[3-(2-hydroxyethyl)phenyl]prop-2-enyl]-2,3-dihydro-1-benzofuran-5-ol
InChI:
InChI=1S/C19H20O3/c20-9-7-15-4-1-3-14(11-15)5-2-6-16-13-19-17(8-10-22-19)12-18(16)21/h1-5,11-13,20-21H,6-10H2
InChI Key:
KDJOCLVJWRTTID-UHFFFAOYSA-N
SMILES:
OCCc1cccc(c1)C=CCc1cc2OCCc2cc1O
Properties
Complexity:
368
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
296.141g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
296.366g/mol
Monoisotopic Mass:
296.141g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
49.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
3.7
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