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128475-33-2 | 1H-Inden-5-ol, 6,6'-[(4-methoxyphenyl)methylene]bis[2,3-dihydro-
CAS No: 128475-33-2 Catalog No: AG000Y4W MDL No:
Product Description
Catalog Number:
AG000Y4W
Chemical Name:
1H-Inden-5-ol, 6,6'-[(4-methoxyphenyl)methylene]bis[2,3-dihydro-
CAS Number:
128475-33-2
Molecular Formula:
C26H26O3
Molecular Weight:
386.4828
IUPAC Name:
6-[(6-hydroxy-2,3-dihydro-1H-inden-5-yl)-(4-methoxyphenyl)methyl]-2,3-dihydro-1H-inden-5-ol
InChI:
InChI=1S/C26H26O3/c1-29-21-10-8-16(9-11-21)26(22-12-17-4-2-6-19(17)14-24(22)27)23-13-18-5-3-7-20(18)15-25(23)28/h8-15,26-28H,2-7H2,1H3
InChI Key:
XBMKUOQQJPUCLX-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)C(c1cc2CCCc2cc1O)c1cc2CCCc2cc1O
Properties
Complexity:
506
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
386.188g/mol
Formal Charge:
0
Heavy Atom Count:
29
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
386.491g/mol
Monoisotopic Mass:
386.188g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
49.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.2
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