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851729-15-2 | Methanone, [3-(4-methoxyphenyl)oxiranyl](3,4,5-trimethoxyphenyl)-
CAS No: 851729-15-2 Catalog No: AG004QOE MDL No:
Product Description
Catalog Number:
AG004QOE
Chemical Name:
Methanone, [3-(4-methoxyphenyl)oxiranyl](3,4,5-trimethoxyphenyl)-
CAS Number:
851729-15-2
Molecular Formula:
C19H20O6
Molecular Weight:
344.3585
IUPAC Name:
[3-(4-methoxyphenyl)oxiran-2-yl]-(3,4,5-trimethoxyphenyl)methanone
InChI:
InChI=1S/C19H20O6/c1-21-13-7-5-11(6-8-13)17-19(25-17)16(20)12-9-14(22-2)18(24-4)15(10-12)23-3/h5-10,17,19H,1-4H3
InChI Key:
BFBOCNWCUSKNOS-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)C1OC1C(=O)c1cc(OC)c(c(c1)OC)OC
Properties
Complexity:
433
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
344.126g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
344.363g/mol
Monoisotopic Mass:
344.126g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
66.5A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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