Cas no 88070-02-4 (Benzene, 1-(1,1-dimethylethyl)-3-methyl-5-(phenylmethyl)-)
88070-02-4 structure
Product Name:Benzene, 1-(1,1-dimethylethyl)-3-methyl-5-(phenylmethyl)-
CAS No:88070-02-4
MF:C18H22
MW:238.367285251617
CID:646357
PubChem ID:13139370
Update Time:2025-04-19
Benzene, 1-(1,1-dimethylethyl)-3-methyl-5-(phenylmethyl)- Chemical and Physical Properties
Names and Identifiers
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- Benzene, 1-(1,1-dimethylethyl)-3-methyl-5-(phenylmethyl)-
- 1-benzyl-3-tert-butyl-5-methylbenzene
- 88070-02-4
- DTXSID00521104
-
- Inchi： 1S/C18H22/c1-14-10-16(12-15-8-6-5-7-9-15)13-17(11-14)18(2,3)4/h5-11,13H,12H2,1-4H3
- InChI Key： SNTFZZLMAHGEEM-UHFFFAOYSA-N
- SMILES： C(C)(C)(C)C1C=C(C)C=C(CC2C=CC=CC=2)C=1
Computed Properties
- Exact Mass: 238.172150702g/mol
- Monoisotopic Mass: 238.172150702g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 0
- Heavy Atom Count: 18
- Rotatable Bond Count: 3
- Complexity: 241
- 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: 5.9
- Topological Polar Surface Area: 0?2
Benzene, 1-(1,1-dimethylethyl)-3-methyl-5-(phenylmethyl)- Related Literature
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Erika A. Cobar,Paul R. Horn,Robert G. Bergman,Martin Head-Gordon Phys. Chem. Chem. Phys., 2012,14, 15328-15339
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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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Tao Wang,Yangyang Liu,Yue Deng,Hongbo Fu,Jianmin Chen Environ. Sci.: Nano, 2018,5, 1821-1833
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Partha Laskar,Christine Dufès Nanoscale Adv., 2021,3, 6007-6026
88070-02-4 (Benzene, 1-(1,1-dimethylethyl)-3-methyl-5-(phenylmethyl)-) Related Products
- 630-76-2(Tetraphenylmethane)
- 1014-60-4(1,3-Di-tert-butylbenzene)
- 612-00-0(Methyldiphenylmethane)
- 1012-72-2(1,4-Di-tert-butylbenzene)
- 519-73-3(Triphenylmethane)
- 1460-02-2(1,3,5-Tri-tert-butylbenzene)
- 98-19-1(1-tert-Butyl-3,5-dimethylbenzene)
- 15181-11-0(3,5-Di-tert-butyltoluene)
- 1075-38-3(3-Tert-Butyltoluene)
- 2098070-20-1(2-(3-(Pyridin-3-yl)-1H-pyrazol-1-yl)acetimidamide)
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