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Home > Other Heterocycles > 77-08-7
77-08-7 | 5,5,6,6-Tetrahydroxy-3,3,3,3-tetramethyl-1,1-spirobisindane, 97+%
CAS No: 77-08-7 Catalog No: AG003M8Q MDL No:MFCD00021235
Product Description
Catalog Number:
AG003M8Q
Chemical Name:
5,5,6,6-Tetrahydroxy-3,3,3,3-tetramethyl-1,1-spirobisindane, 97+%
CAS Number:
77-08-7
Molecular Formula:
C21H24O4
Molecular Weight:
340.4129
MDL Number:
MFCD00021235
IUPAC Name:
1,1,1',1'-tetramethyl-3,3'-spirobi[2H-indene]-5,5',6,6'-tetrol
InChI:
InChI=1S/C21H24O4/c1-19(2)9-21(13-7-17(24)15(22)5-11(13)19)10-20(3,4)12-6-16(23)18(25)8-14(12)21/h5-8,22-25H,9-10H2,1-4H3
InChI Key:
POFMQEVZKZVAPQ-UHFFFAOYSA-N
SMILES:
CC1(C)CC2(c3c1cc(O)c(c3)O)CC(c1c2cc(O)c(c1)O)(C)C
EC Number:
201-003-1
Properties
Complexity:
494
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
340.167g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
340.419g/mol
Monoisotopic Mass:
340.167g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
80.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.1
Literature
| Title | Journal |
|---|---|
| Tetraanionic organoborate squares glued together by cations to generate nanotubular stacks. | Angewandte Chemie (International ed. in English) 20060123 |
| A new class of HIV-1 integrase inhibitors: the 3,3,3', 3'-tetramethyl-1,1'-spirobi(indan)-5,5',6,6'-tetrol family. | Journal of medicinal chemistry 20000518 |
| Human immunodeficiency virus type 1 cDNA integration: new aromatic hydroxylated inhibitors and studies of the inhibition mechanism. | Antimicrobial agents and chemotherapy 19980901 |
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