Cas no 950-56-1 (Phenol,3,5-bis(1,1-dimethylethyl)-4-methyl-)
950-56-1 structure
Product Name:Phenol,3,5-bis(1,1-dimethylethyl)-4-methyl-
CAS No:950-56-1
MF:C15H24O
MW:220.350464820862
CID:809900
PubChem ID:10220096
Update Time:2025-04-19
Phenol,3,5-bis(1,1-dimethylethyl)-4-methyl- Chemical and Physical Properties
Names and Identifiers
-
- Phenol,3,5-bis(1,1-dimethylethyl)-4-methyl-
- 3,5-di-tert-butyl-4-hydroxytoluene
- SCHEMBL105825
- CHEMBL3093613
- 2,6-Ditert-buthyl-4-hydroxy toluene
- 3,5-di-tert-butyl-4-methylphenol
- 950-56-1
- 2,6-di-t-butyl-4-hydroxytoluene
-
- Inchi： 1S/C15H24O/c1-10-12(14(2,3)4)8-11(16)9-13(10)15(5,6)7/h8-9,16H,1-7H3
- InChI Key： SMNGQGWPUVVORF-UHFFFAOYSA-N
- SMILES： OC1C=C(C(C)=C(C=1)C(C)(C)C)C(C)(C)C
Computed Properties
- Exact Mass: 220.182715385g/mol
- Monoisotopic Mass: 220.182715385g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 16
- Rotatable Bond Count: 2
- Complexity: 207
- 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
- Surface Charge: 0
- Tautomer Count: 2
- XLogP3: 5.3
- Topological Polar Surface Area: 20.2?2
Phenol,3,5-bis(1,1-dimethylethyl)-4-methyl- Related Literature
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Long Deng,Qian Zou,Biao Liu,Wenhui Ye,Chengfei Zhuo,Li Chen,Ze-Yuan Deng,Ya-Wei Fan,Jing Li Food Funct., 2018,9, 4234-4245
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Joseph H. Bisesi,Tara Sabo-Attwood Environ. Sci.: Nano, 2014,1, 574-583
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Ivor Lon?ari? Phys. Chem. Chem. Phys., 2015,17, 9436-9445
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4. Excimer emission and magnetoluminescence of radical-based zinc(ii) complexes doped in host crystals?Shojiro Kimura,Tetsuro Kusamoto Chem. Commun., 2020,56, 11195-11198
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Ross Harder,David C. Dunand,Ian McNulty Nanoscale, 2017,9, 5686-5693
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