Cas no 799-13-3 (4-tert-butyl-2-[(5-tert-butyl-2-hydroxyphenyl)methyl]phenol)
![4-tert-butyl-2-[(5-tert-butyl-2-hydroxyphenyl)methyl]phenol structure](https://ossimg.kuujia.com/scimg/1000/799-13-3x500.png)
799-13-3 structure
Product Name:4-tert-butyl-2-[(5-tert-butyl-2-hydroxyphenyl)methyl]phenol
CAS No:799-13-3
MF:C21H28O2
MW:312.445826530457
CID:1799077
PubChem ID:241060
Update Time:2025-04-21
4-tert-butyl-2-[(5-tert-butyl-2-hydroxyphenyl)methyl]phenol Chemical and Physical Properties
Names and Identifiers
-
- 4-tert-butyl-2-[(5-tert-butyl-2-hydroxyphenyl)methyl]phenol
- 2,2'-METHANEDIYLBIS(4-TERT-BUTYLPHENOL)
- AC1L66JA
- 4,4'-di-tert-butyl-2,2'-methanediyldiphenol
- AG-K-20750
- CHEMBL481993
- 4,4'-di-tert-butyl-2,2'-dihydroxybiphenyl
- Bis-(6-hydroxy-3-tert.-butyl-phenyl)-methan
- bis(5-tert-butyl-2-hydroxyphenyl)methane
- CTK5E7240
- NSC48161
- 4,4'-di-tert-butyl-2,2'-methanediyl-di-phenol
- SureCN51058
- 4,4'-Di-tert-butyl-2,2'-methandiyl-di-phenol
- 799-13-3
- SCHEMBL51058
- NSC-48161
- BDBM34131
- 2,2'-methylenebis(4-t-butylphenol)
- 2,2-methanediylbis(4-tert-butylphenol), 5a
- 2,2'-Dihydroxy-5,5'-ditert.-butyl-diphenylmethan
- DTXSID60286883
-
- Inchi： 1S/C21H28O2/c1-20(2,3)16-7-9-18(22)14(12-16)11-15-13-17(21(4,5)6)8-10-19(15)23/h7-10,12-13,22-23H,11H2,1-6H3
- InChI Key： RXAGDDKHRDAVLM-UHFFFAOYSA-N
- SMILES： OC1C=CC(=CC=1CC1=C(C=CC(=C1)C(C)(C)C)O)C(C)(C)C
Computed Properties
- Exact Mass: 312.20904
- Monoisotopic Mass: 312.208930132g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 23
- Rotatable Bond Count: 4
- Complexity: 340
- 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: 6.5
- Topological Polar Surface Area: 40.5?2
Experimental Properties
- PSA: 40.46
- LogP: 5.28360
4-tert-butyl-2-[(5-tert-butyl-2-hydroxyphenyl)methyl]phenol Related Literature
-
Xing Zhao,Lu Bai,Rui-Ying Bao,Zheng-Ying Liu,Ming-Bo Yang,Wei Yang RSC Adv., 2017,7, 46297-46305
-
Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
-
Partha Laskar,Christine Dufès Nanoscale Adv., 2021,3, 6007-6026
-
Hongxia Li,Aikifa Raza,Qiaoyu Ge,Jin-You Lu,TieJun Zhang Soft Matter, 2020,16, 6841-6849
-
Gang Pan,Yi-jie Bao,Jie Xu,Tao Liu,Cheng Liu,Yan-yan Qiu,Xiao-jing Shi,Hui Yu,Ting-ting Jia,Xia Yuan,Ze-ting Yuan,Yi-jun Cao RSC Adv., 2016,6, 42109-42119
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