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138591-47-6 | 1,1'-Biphenyl, 2,2',5-trimethoxy-5'-(2-propen-1-yl)-
CAS No: 138591-47-6 Catalog No: AG0018TE MDL No:
Product Description
Catalog Number:
AG0018TE
Chemical Name:
1,1'-Biphenyl, 2,2',5-trimethoxy-5'-(2-propen-1-yl)-
CAS Number:
138591-47-6
Molecular Formula:
C18H20O3
Molecular Weight:
284.3496
IUPAC Name:
1,4-dimethoxy-2-(2-methoxy-5-prop-2-enylphenyl)benzene
InChI:
InChI=1S/C18H20O3/c1-5-6-13-7-9-17(20-3)15(11-13)16-12-14(19-2)8-10-18(16)21-4/h5,7-12H,1,6H2,2-4H3
InChI Key:
GVPZNFLBLJQCGB-UHFFFAOYSA-N
SMILES:
C=CCc1ccc(c(c1)c1cc(OC)ccc1OC)OC
Properties
Complexity:
318
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
284.141g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
284.355g/mol
Monoisotopic Mass:
284.141g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
27.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.5
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