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102415-87-2 | Benzene, 1-[(3,4-dimethoxyphenyl)methyl]-4,5-dimethoxy-2-methyl-
CAS No: 102415-87-2 Catalog No: AG0007EP MDL No:
Product Description
Catalog Number:
AG0007EP
Chemical Name:
Benzene, 1-[(3,4-dimethoxyphenyl)methyl]-4,5-dimethoxy-2-methyl-
CAS Number:
102415-87-2
Molecular Formula:
C18H22O4
Molecular Weight:
302.3649
IUPAC Name:
1-[(3,4-dimethoxyphenyl)methyl]-4,5-dimethoxy-2-methylbenzene
InChI:
InChI=1S/C18H22O4/c1-12-8-16(20-3)18(22-5)11-14(12)9-13-6-7-15(19-2)17(10-13)21-4/h6-8,10-11H,9H2,1-5H3
InChI Key:
LXYWOXRJYYAWKU-UHFFFAOYSA-N
SMILES:
COc1cc(ccc1OC)Cc1cc(OC)c(cc1C)OC
Properties
Complexity:
322
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
302.152g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
302.37g/mol
Monoisotopic Mass:
302.152g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
36.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1
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