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84145-55-1 | Benzene,1-(3,3-dimethoxypropyl)-4-(1,1-dimethylethyl)-
CAS No: 84145-55-1 Catalog No: AG004SH7 MDL No:
Product Description
Catalog Number:
AG004SH7
Chemical Name:
Benzene,1-(3,3-dimethoxypropyl)-4-(1,1-dimethylethyl)-
CAS Number:
84145-55-1
Molecular Formula:
C15H24O2
Molecular Weight:
236.3499
IUPAC Name:
1-tert-butyl-4-(3,3-dimethoxypropyl)benzene
InChI:
InChI=1S/C15H24O2/c1-15(2,3)13-9-6-12(7-10-13)8-11-14(16-4)17-5/h6-7,9-10,14H,8,11H2,1-5H3
InChI Key:
HVZIFEPQRGVYQS-UHFFFAOYSA-N
SMILES:
COC(CCc1ccc(cc1)C(C)(C)C)OC
EC Number:
282-282-7
Properties
Complexity:
196
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
236.178g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
236.355g/mol
Monoisotopic Mass:
236.178g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1
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