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127988-88-9 | 6-Benzofuranol, 2-(4-hydroxyphenyl)-3-methyl-
CAS No: 127988-88-9 Catalog No: AG000XNE MDL No:
Product Description
Catalog Number:
AG000XNE
Chemical Name:
6-Benzofuranol, 2-(4-hydroxyphenyl)-3-methyl-
CAS Number:
127988-88-9
Molecular Formula:
C15H12O3
Molecular Weight:
240.2540
IUPAC Name:
2-(4-hydroxyphenyl)-3-methyl-1-benzofuran-6-ol
InChI:
InChI=1S/C15H12O3/c1-9-13-7-6-12(17)8-14(13)18-15(9)10-2-4-11(16)5-3-10/h2-8,16-17H,1H3
InChI Key:
XGYQHARJDOHMBS-UHFFFAOYSA-N
SMILES:
Oc1ccc(cc1)c1oc2c(c1C)ccc(c2)O
Properties
Complexity:
286
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
240.079g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
240.258g/mol
Monoisotopic Mass:
240.079g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
53.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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