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138002-57-0 | Benzene, 1-[1-(3,4-dimethoxyphenyl)-2-methylpropyl]-2,3-dimethoxy-
CAS No: 138002-57-0 Catalog No: AG0017TW MDL No:
Product Description
Catalog Number:
AG0017TW
Chemical Name:
Benzene, 1-[1-(3,4-dimethoxyphenyl)-2-methylpropyl]-2,3-dimethoxy-
CAS Number:
138002-57-0
Molecular Formula:
C20H26O4
Molecular Weight:
330.4180
IUPAC Name:
1-[1-(3,4-dimethoxyphenyl)-2-methylpropyl]-2,3-dimethoxybenzene
InChI:
InChI=1S/C20H26O4/c1-13(2)19(14-10-11-16(21-3)18(12-14)23-5)15-8-7-9-17(22-4)20(15)24-6/h7-13,19H,1-6H3
InChI Key:
CDIJZMOFFFXVRB-UHFFFAOYSA-N
SMILES:
COc1cc(ccc1OC)C(c1cccc(c1OC)OC)C(C)C
Properties
Complexity:
360
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
330.183g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
330.424g/mol
Monoisotopic Mass:
330.183g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
36.9A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
4.9
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