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144425-92-3 | 1,4-Benzenediol, 2-(1,1-dimethylethyl)-5-(1,1-dimethylpropyl)-
CAS No: 144425-92-3 Catalog No: AG001JIN MDL No:
Product Description
Catalog Number:
AG001JIN
Chemical Name:
1,4-Benzenediol, 2-(1,1-dimethylethyl)-5-(1,1-dimethylpropyl)-
CAS Number:
144425-92-3
Molecular Formula:
C15H24O2
Molecular Weight:
236.3499
IUPAC Name:
2-tert-butyl-5-(2-methylbutan-2-yl)benzene-1,4-diol
InChI:
InChI=1S/C15H24O2/c1-7-15(5,6)11-9-12(16)10(8-13(11)17)14(2,3)4/h8-9,16-17H,7H2,1-6H3
InChI Key:
VXUQJEMWECBYRC-UHFFFAOYSA-N
SMILES:
CCC(c1cc(O)c(cc1O)C(C)(C)C)(C)C
Properties
Complexity:
252
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:
2
Isotope Atom Count:
0
Molecular Weight:
236.355g/mol
Monoisotopic Mass:
236.178g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.1
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