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88133-95-3 | Methanone, (2,5-dimethoxyphenyl)(2-hydroxy-4,5-dimethoxyphenyl)-
CAS No: 88133-95-3 Catalog No: AG004DH4 MDL No:
Product Description
Catalog Number:
AG004DH4
Chemical Name:
Methanone, (2,5-dimethoxyphenyl)(2-hydroxy-4,5-dimethoxyphenyl)-
CAS Number:
88133-95-3
Molecular Formula:
C17H18O6
Molecular Weight:
318.3212
IUPAC Name:
(2,5-dimethoxyphenyl)-(2-hydroxy-4,5-dimethoxyphenyl)methanone
InChI:
InChI=1S/C17H18O6/c1-20-10-5-6-14(21-2)12(7-10)17(19)11-8-15(22-3)16(23-4)9-13(11)18/h5-9,18H,1-4H3
InChI Key:
JFVOCPIAPHHHQL-UHFFFAOYSA-N
SMILES:
COc1ccc(c(c1)C(=O)c1cc(OC)c(cc1O)OC)OC
Properties
Complexity:
387
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
318.11g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
318.325g/mol
Monoisotopic Mass:
318.11g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
74.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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