Cas no 13379-84-5 ([1,1'-Biphenyl]-2,4,4'-triol,3,3',5,5'-tetramethyl-)
![[1,1'-Biphenyl]-2,4,4'-triol,3,3',5,5'-tetramethyl- structure](https://ossimg.kuujia.com/scimg/13500/13379-84-5x500.png)
13379-84-5 structure
Product Name:[1,1'-Biphenyl]-2,4,4'-triol,3,3',5,5'-tetramethyl-
CAS No:13379-84-5
MF:C16H18O3
MW:258.312325000763
CID:119525
PubChem ID:19987619
Update Time:2025-04-18
[1,1'-Biphenyl]-2,4,4'-triol,3,3',5,5'-tetramethyl- Chemical and Physical Properties
Names and Identifiers
-
- [1,1'-Biphenyl]-2,4,4'-triol,3,3',5,5'-tetramethyl-
- 2,4,4-Biphenyltriol,3,3,5,5-tetramethyl-(8CI)
- 13379-84-5
- 4-(4-hydroxy-3,5-dimethylphenyl)-2,6-dimethylbenzene-1,3-diol
- SCHEMBL9571457
-
- Inchi： 1S/C16H18O3/c1-8-5-12(6-9(2)14(8)17)13-7-10(3)15(18)11(4)16(13)19/h5-7,17-19H,1-4H3
- InChI Key： BMNJDNVZGPEPIN-UHFFFAOYSA-N
- SMILES： OC1C(C)=C(C(C)=CC=1C1C=C(C)C(=C(C)C=1)O)O
Computed Properties
- Exact Mass: 262.15696
- Monoisotopic Mass: 258.125594432g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 3
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 19
- Rotatable Bond Count: 1
- Complexity: 294
- 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
- XLogP3: 3.9
- Topological Polar Surface Area: 60.7?2
Experimental Properties
- PSA: 60.69
[1,1'-Biphenyl]-2,4,4'-triol,3,3',5,5'-tetramethyl- Related Literature
-
Andreas Nenning,Manuel Holzmann,Jürgen Fleig,Alexander K. Opitz Mater. Adv., 2021,2, 5422-5431
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Amit Kumar Majhi,Subbarao Kanchi,V. Venkataraman,K. G. Ayappa,Prabal K. Maiti Soft Matter, 2015,11, 8632-8640
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Ji-Ping Wei Nanoscale, 2015,7, 11815-11832
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Joseph H. Bisesi,Tara Sabo-Attwood Environ. Sci.: Nano, 2014,1, 574-583
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