Cas no 2901-24-8 (Benzeneacetic acid, a,a-dimethyl-, 1,1-dimethylethyl ester)
2901-24-8 structure
Product Name:Benzeneacetic acid, a,a-dimethyl-, 1,1-dimethylethyl ester
CAS No:2901-24-8
MF:C14H20O2
MW:220.307404518127
CID:262185
PubChem ID:258638
Update Time:2025-04-19
Benzeneacetic acid, a,a-dimethyl-, 1,1-dimethylethyl ester Chemical and Physical Properties
Names and Identifiers
-
- Benzeneacetic acid, a,a-dimethyl-, 1,1-dimethylethyl ester
- tert-butyl 2-methyl-2-phenylpropanoate
- DTXSID80293211
- NSC87842
- NSC-87842
- 2901-24-8
- AKOS013211031
-
- Inchi： 1S/C14H20O2/c1-13(2,3)16-12(15)14(4,5)11-9-7-6-8-10-11/h6-10H,1-5H3
- InChI Key： SFYZTHTWCLEXHJ-UHFFFAOYSA-N
- SMILES： O(C(C(C)(C)C1C=CC=CC=1)=O)C(C)(C)C
Computed Properties
- Exact Mass: 220.1464
- Monoisotopic Mass: 220.146329876g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 16
- Rotatable Bond Count: 4
- Complexity: 242
- 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: 3.6
- Topological Polar Surface Area: 26.3?2
Experimental Properties
- PSA: 26.3
Benzeneacetic acid, a,a-dimethyl-, 1,1-dimethylethyl ester Related Literature
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J. Matthew Kurley,Phillip W. Halstenberg,Abbey McAlister,Stephen Raiman,Richard T. Mayes RSC Adv., 2019,9, 25602-25608
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Alexandre Vimont,Arnaud Travert,Philippe Bazin,Jean-Claude Lavalley,Marco Daturi,Christian Serre,Gérard Férey,Sandrine Bourrelly,Philip L. Llewellyn Chem. Commun., 2007, 3291-3293
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Albertus D. Handoko,Khoong Hong Khoo,Teck Leong Tan,Hongmei Jin,Zhi Wei Seh J. Mater. Chem. A, 2018,6, 21885-21890
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Liao Xiaoqing,Li Ruiyi,Li Zaijun,Sun Xiulan,Wang Zhouping,Liu Junkang New J. Chem., 2015,39, 5240-5248
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Jing Yu,Yu-Qi Lyu,Jiapeng Liu,Mohammed B. Effat,Junxiong Wu J. Mater. Chem. A, 2019,7, 17995-18002
2901-24-8 (Benzeneacetic acid, a,a-dimethyl-, 1,1-dimethylethyl ester) Related Products
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- 111170-56-0(Benzeneacetic acid, a-methyl-, ethyl ester, (aR)-)
- 2510-99-8(2-Phenylpropionic Acid Ethyl Ester)
- 42253-99-6(Benzeneacetic acid, a-methyl-, ethyl ester, (aS)-)
- 2098070-20-1(2-(3-(Pyridin-3-yl)-1H-pyrazol-1-yl)acetimidamide)
- 2680771-01-9(4-cyclopentyl-3-{(prop-2-en-1-yloxy)carbonylamino}butanoic acid)
- 1444113-98-7(N-(3-cyanothiolan-3-yl)-2-[(2,2,2-trifluoroethyl)sulfanyl]pyridine-4-carboxamide)
- 332062-08-5(Fmoc-S-3-amino-4,4-diphenyl-butyric acid)
- 1270529-38-8(1,2,3,4,5,6-Hexahydro-[2,3]bipyridinyl-6-ol)
- 941977-17-9(N'-(3-chloro-2-methylphenyl)-N-2-(dimethylamino)-2-(naphthalen-1-yl)ethylethanediamide)
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