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865836-87-9 | Triphenylene-2,3,6,7,10,11-hexaol hydrate
CAS No: 865836-87-9 Catalog No: AG01FOWQ MDL No:
Product Description
Catalog Number:
AG01FOWQ
Chemical Name:
Triphenylene-2,3,6,7,10,11-hexaol hydrate
CAS Number:
865836-87-9
IUPAC Name:
triphenylene-2,3,6,7,10,11-hexol;hydrate
InChI:
InChI=1S/C18H12O6.H2O/c19-13-1-7-8(2-14(13)20)10-4-17(23)18(24)6-12(10)11-5-16(22)15(21)3-9(7)11;/h1-6,19-24H;1H2
InChI Key:
RRFZCJGLIHVKTK-UHFFFAOYSA-N
Properties
Complexity:
364
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
342.074g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
7
Isotope Atom Count:
0
Molecular Weight:
342.303g/mol
Monoisotopic Mass:
342.074g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
122A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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