Cas no 5415-86-1 (Propanedioic acid,2-(1,1-dimethyl-2-phenylethyl)-, 1,3-diethyl ester)
5415-86-1 structure
Product Name:Propanedioic acid,2-(1,1-dimethyl-2-phenylethyl)-, 1,3-diethyl ester
CAS No:5415-86-1
MF:C17H24O4
MW:292.370065689087
CID:379148
PubChem ID:223572
Update Time:2025-04-19
Propanedioic acid,2-(1,1-dimethyl-2-phenylethyl)-, 1,3-diethyl ester Chemical and Physical Properties
Names and Identifiers
-
- Propanedioic acid,2-(1,1-dimethyl-2-phenylethyl)-, 1,3-diethyl ester
- diethyl 2-(2-methyl-1-phenylpropan-2-yl)propanedioate
- (1,1-Dimethyl-2-phenyl-aethyl)-malonsaeure-diaethylester
- (1,1-dimethyl-2-phenyl-ethyl)-malonic acid diethyl ester
- < 2-Methyl-1-phenyl-propyl-(2)> -malonsaeure-diaethylester
- AC1L5CNU
- AC1Q63SW
- AG-J-88202
- AR-1I4877
- CTK4J9839
- diethyl(2-methyl-1-phenylpropan-2-yl)propanedioate
- NSC11309
- 5415-86-1
- DTXSID60279119
- NSC-11309
-
- Inchi： 1S/C17H24O4/c1-5-20-15(18)14(16(19)21-6-2)17(3,4)12-13-10-8-7-9-11-13/h7-11,14H,5-6,12H2,1-4H3
- InChI Key： BLZXJYSGUIUTLS-UHFFFAOYSA-N
- SMILES： O(CC)C(C(C(=O)OCC)C(C)(C)CC1C=CC=CC=1)=O
Computed Properties
- Exact Mass: 292.16752
- Monoisotopic Mass: 292.16745924g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 21
- Rotatable Bond Count: 9
- Complexity: 325
- 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: 4.1
- Topological Polar Surface Area: 52.6?2
Experimental Properties
- PSA: 52.6
- LogP: 2.99770
Propanedioic acid,2-(1,1-dimethyl-2-phenylethyl)-, 1,3-diethyl ester Related Literature
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Dan Yang,Yanping Zhou,Xianhong Rui,Jixin Zhu,Ziyang Lu,Eileen Fong,Qingyu Yan RSC Adv., 2013,3, 14960-14962
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Tengfei Yu,Yuehan Wu,Wei Li,Bin Li RSC Adv., 2014,4, 34134-34143
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Byungho Lim,Jaewon Jin,Jin Yoo,Seung Yong Han,Kyeongyeol Kim,Sungah Kang,Nojin Park,Sang Moon Lee,Hae Jin Kim,Seung Uk Son Chem. Commun., 2014,50, 7723-7726
-
Fereshteh Bayat Environ. Sci.: Nano, 2021,8, 367-389
5415-86-1 (Propanedioic acid,2-(1,1-dimethyl-2-phenylethyl)-, 1,3-diethyl ester) Related Products
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