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177941-34-3 | Benzene, 1-methoxy-4-(1-methoxy-2,2-dimethylpropyl)-
CAS No: 177941-34-3 Catalog No: AG0025N4 MDL No:
Product Description
Catalog Number:
AG0025N4
Chemical Name:
Benzene, 1-methoxy-4-(1-methoxy-2,2-dimethylpropyl)-
CAS Number:
177941-34-3
Molecular Formula:
C13H20O2
Molecular Weight:
208.2967
IUPAC Name:
1-methoxy-4-(1-methoxy-2,2-dimethylpropyl)benzene
InChI:
InChI=1S/C13H20O2/c1-13(2,3)12(15-5)10-6-8-11(14-4)9-7-10/h6-9,12H,1-5H3
InChI Key:
RWTUCSQCWWSYMM-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)C(C(C)(C)C)OC
Properties
Complexity:
176
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:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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