Cas no 93893-68-6 (1H-Inden-5-ol,4,4'-methylenebis[6-(1,1-dimethylethyl)-2,3-dihydro-1,1,3,3-tetramethyl-)
93893-68-6 structure
Product Name:1H-Inden-5-ol,4,4'-methylenebis[6-(1,1-dimethylethyl)-2,3-dihydro-1,1,3,3-tetramethyl-
CAS No:93893-68-6
MF:C35H52O2
MW:504.786190986633
CID:813750
PubChem ID:44146380
Update Time:2025-04-19
1H-Inden-5-ol,4,4'-methylenebis[6-(1,1-dimethylethyl)-2,3-dihydro-1,1,3,3-tetramethyl- Chemical and Physical Properties
Names and Identifiers
-
- 4,4'-methylenebis[6-(tert-butyl)-1,1,3,3-tetramethylindan-5-ol]
- 6-tert-butyl-4-[(6-tert-butyl-5-hydroxy-1,1,3,3-tetramethyl-2H-inden-4-yl)methyl]-1,1,3,3-tetramethyl-2H-inden-5-ol
- NS00063980
- 93893-68-6
- DTXSID40917284
- EINECS 299-659-7
- 4,4'-Methylenebis(6-(tert-butyl)-1,1,3,3-tetramethylindan-5-ol)
- 4,4'-Methylenebis(6-tert-butyl-1,1,3,3-tetramethyl-2,3-dihydro-1H-inden-5-ol)
- 1H-Inden-5-ol,4,4'-methylenebis[6-(1,1-dimethylethyl)-2,3-dihydro-1,1,3,3-tetramethyl-
-
- Inchi： 1S/C35H52O2/c1-30(2,3)24-16-22-26(34(11,12)18-32(22,7)8)20(28(24)36)15-21-27-23(33(9,10)19-35(27,13)14)17-25(29(21)37)31(4,5)6/h16-17,36-37H,15,18-19H2,1-14H3
- InChI Key： YFVWRGVVIOMGGV-UHFFFAOYSA-N
- SMILES： OC1C(C(C)(C)C)=CC2=C(C=1CC1=C(C(C(C)(C)C)=CC3=C1C(C)(C)CC3(C)C)O)C(C)(C)CC2(C)C
Computed Properties
- Exact Mass: 504.397
- Monoisotopic Mass: 504.397
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 37
- Rotatable Bond Count: 4
- Complexity: 780
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 40.5A^2
- XLogP3: 11.6
Experimental Properties
- Density: 0.988
- Boiling Point: 519.5°C at 760 mmHg
- Flash Point: 195.2°C
- Refractive Index: 1.529
1H-Inden-5-ol,4,4'-methylenebis[6-(1,1-dimethylethyl)-2,3-dihydro-1,1,3,3-tetramethyl- Related Literature
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Juan J. Sánchez,Miguel López-Haro,Juan C. Hernández-Garrido,Ginesa Blanco,Miguel A. Cauqui,José M. Rodríguez-Izquierdo,José A. Pérez-Omil,José J. Calvino,María P. Yeste J. Mater. Chem. A, 2019,7, 8993-9003
-
Huiying Xu,Lu Zheng,Yu Zhou,Bang-Ce Ye Analyst, 2021,146, 5542-5549
-
Doug Ogrin,Laura H. van Poppel,Simon G. Bott,Andrew R. Barron Dalton Trans., 2004, 3689-3694
-
Luis Miguel Azofra,Douglas R. MacFarlane,Chenghua Sun Chem. Commun., 2016,52, 3548-3551
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Jieun Kim,Han-Saem Park,Tae-Hee Kim,Sung Yeol Kim,Hyun-Kon Song Phys. Chem. Chem. Phys., 2014,16, 5295-5300
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