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116447-65-5 | Methanone, (2-methoxyphenyl)(2,3,4,5-tetramethoxyphenyl)-
CAS No: 116447-65-5 Catalog No: AG000CIK MDL No:
Product Description
Catalog Number:
AG000CIK
Chemical Name:
Methanone, (2-methoxyphenyl)(2,3,4,5-tetramethoxyphenyl)-
CAS Number:
116447-65-5
Molecular Formula:
C18H20O6
Molecular Weight:
332.3478
IUPAC Name:
(2-methoxyphenyl)-(2,3,4,5-tetramethoxyphenyl)methanone
InChI:
InChI=1S/C18H20O6/c1-20-13-9-7-6-8-11(13)15(19)12-10-14(21-2)17(23-4)18(24-5)16(12)22-3/h6-10H,1-5H3
InChI Key:
PHJPQXCAOMMCFS-UHFFFAOYSA-N
SMILES:
COc1cc(C(=O)c2ccccc2OC)c(c(c1OC)OC)OC
Properties
Complexity:
401
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
332.126g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
332.352g/mol
Monoisotopic Mass:
332.126g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
63.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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