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83816-35-7 | Benzene, 1-(1,1-dimethylpropyl)-3,5-dimethoxy-
CAS No: 83816-35-7 Catalog No: AG004W1B MDL No:
Product Description
Catalog Number:
AG004W1B
Chemical Name:
Benzene, 1-(1,1-dimethylpropyl)-3,5-dimethoxy-
CAS Number:
83816-35-7
Molecular Formula:
C13H20O2
Molecular Weight:
208.2967
IUPAC Name:
1,3-dimethoxy-5-(2-methylbutan-2-yl)benzene
InChI:
InChI=1S/C13H20O2/c1-6-13(2,3)10-7-11(14-4)9-12(8-10)15-5/h7-9H,6H2,1-5H3
InChI Key:
OZSWIQLYEWBZJO-UHFFFAOYSA-N
SMILES:
CCC(c1cc(OC)cc(c1)OC)(C)C
Properties
Complexity:
177
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
208.146g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
208.301g/mol
Monoisotopic Mass:
208.146g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1
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