Cas no 89297-45-0 (Phenol, 4,4'-methylenebis[2,6-bis(1,1-dimethylethyl)-3-methyl-)
89297-45-0 structure
Product Name:Phenol, 4,4'-methylenebis[2,6-bis(1,1-dimethylethyl)-3-methyl-
CAS No:89297-45-0
MF:C31H48O2
MW:452.711629867554
CID:604940
PubChem ID:14298653
Update Time:2025-04-19
Phenol, 4,4'-methylenebis[2,6-bis(1,1-dimethylethyl)-3-methyl- Chemical and Physical Properties
Names and Identifiers
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- 2,6-ditert-butyl-4-[(3,5-ditert-butyl-4-hydroxy-2-methylphenyl)methyl]-3-methylphenol
- SCHEMBL10708543
- DTXSID10558663
- 4,4'-Methylenebis(2,6-di-tert-butyl-3-methylphenol)
- 89297-45-0
- Phenol, 4,4'-methylenebis[2,6-bis(1,1-dimethylethyl)-3-methyl-
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- Inchi： 1S/C31H48O2/c1-18-20(16-22(28(3,4)5)26(32)24(18)30(9,10)11)15-21-17-23(29(6,7)8)27(33)25(19(21)2)31(12,13)14/h16-17,32-33H,15H2,1-14H3
- InChI Key： UJYDTMKXUMMZOG-UHFFFAOYSA-N
- SMILES： OC1=C(C=C(C(C)=C1C(C)(C)C)CC1=CC(=C(C(=C1C)C(C)(C)C)O)C(C)(C)C)C(C)(C)C
Computed Properties
- Exact Mass: 452.365430770g/mol
- Monoisotopic Mass: 452.365430770g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 33
- Rotatable Bond Count: 6
- Complexity: 582
- 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: 10.5
- Topological Polar Surface Area: 40.5?2
Phenol, 4,4'-methylenebis[2,6-bis(1,1-dimethylethyl)-3-methyl- Related Literature
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M. T. Colomer,S. Díaz-Moreno,A. Tamayo,A. L. Ortiz J. Mater. Chem. C, 2018,6, 12643-12651
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Stephen P. Fletcher,Richard B. C. Jagt,Ben L. Feringa Chem. Commun., 2007, 2578-2580
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Huabin Zhang,Shaowu Du CrystEngComm, 2014,16, 4059-4068
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Philipp Traber,Stephan Kupfer,Stefanie Gr?fe,Isabelle Baussanne,Martine Demeunynck,Jean-Marie Mouesca,Serge Gambarelli,Vincent Artero,Murielle Chavarot-Kerlidou Chem. Sci., 2018,9, 4152-4159
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Quan Xiang,Yiqin Chen,Zhiqin Li,Kaixi Bi,Guanhua Zhang,Huigao Duan Nanoscale, 2016,8, 19541-19550
89297-45-0 (Phenol, 4,4'-methylenebis[2,6-bis(1,1-dimethylethyl)-3-methyl-) Related Products
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