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129236-44-8 | Phenol, 4,4'-(1-methylethylidene)bis-, 1,1'-dimethanesulfonate
CAS No: 129236-44-8 Catalog No: AG000Z0D MDL No:
Product Description
Catalog Number:
AG000Z0D
Chemical Name:
Phenol, 4,4'-(1-methylethylidene)bis-, 1,1'-dimethanesulfonate
CAS Number:
129236-44-8
IUPAC Name:
4-[2-(4-hydroxyphenyl)propan-2-yl]phenol;methanesulfonic acid
InChI:
InChI=1S/C15H16O2.2CH4O3S/c1-15(2,11-3-7-13(16)8-4-11)12-5-9-14(17)10-6-12;2*1-5(2,3)4/h3-10,16-17H,1-2H3;2*1H3,(H,2,3,4)
InChI Key:
WEQHQUMJLMWXLY-UHFFFAOYSA-N
Properties
Complexity:
302
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
420.091g/mol
Formal Charge:
0
Heavy Atom Count:
27
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
420.491g/mol
Monoisotopic Mass:
420.091g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
166A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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