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88544-89-2 | Benzene, 2-methoxy-4-(1-methoxy-1-methylethyl)-1-methyl-
CAS No: 88544-89-2 Catalog No: AG004DP6 MDL No:
Product Description
Catalog Number:
AG004DP6
Chemical Name:
Benzene, 2-methoxy-4-(1-methoxy-1-methylethyl)-1-methyl-
CAS Number:
88544-89-2
Molecular Formula:
C12H18O2
Molecular Weight:
194.2701
IUPAC Name:
2-methoxy-4-(2-methoxypropan-2-yl)-1-methylbenzene
InChI:
InChI=1S/C12H18O2/c1-9-6-7-10(8-11(9)13-4)12(2,3)14-5/h6-8H,1-5H3
InChI Key:
LSUXZBJJELKTBY-UHFFFAOYSA-N
SMILES:
COc1cc(ccc1C)C(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:
194.131g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
194.274g/mol
Monoisotopic Mass:
194.131g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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