Cas no 16397-74-3 (Cyclohexanecarboxylicacid, 2-ethylhexyl ester)
16397-74-3 structure
Product Name:Cyclohexanecarboxylicacid, 2-ethylhexyl ester
CAS No:16397-74-3
MF:C15H28O2
MW:240.381625175476
CID:175785
PubChem ID:85993
Update Time:2025-04-19
Cyclohexanecarboxylicacid, 2-ethylhexyl ester Chemical and Physical Properties
Names and Identifiers
-
- Cyclohexanecarboxylicacid, 2-ethylhexyl ester
- 2-ethylhexyl cyclohexanecarboxylate
- Einecs 240-446-5
- Cyclohexanecarboxylic acid 2-ethylhexyl ester
- DTXSID20936892
- 2-ethylhexylcyclohexanoate
- SCHEMBL2475295
- 16397-74-3
- LIIGSIGMAHCMQM-UHFFFAOYSA-N
- NS00052779
- Cyclohexanecarboxylic acid, 2-ethylhexyl ester
- 2-Ethylhexyl cyclohexanecarboxylate #
-
- Inchi： 1S/C15H28O2/c1-3-5-9-13(4-2)12-17-15(16)14-10-7-6-8-11-14/h13-14H,3-12H2,1-2H3
- InChI Key： LIIGSIGMAHCMQM-UHFFFAOYSA-N
- SMILES： O(CC(CC)CCCC)C(C1CCCCC1)=O
Computed Properties
- Exact Mass: 240.20904
- Monoisotopic Mass: 240.208930132g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 17
- Rotatable Bond Count: 8
- Complexity: 207
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 5.3
- Topological Polar Surface Area: 26.3?2
Experimental Properties
- PSA: 26.3
Cyclohexanecarboxylicacid, 2-ethylhexyl ester Related Literature
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Joseph W. Bennett,Diamond T. Jones,Blake G. Hudson,Joshua Melendez-Rivera,Robert J. Hamers,Sara E. Mason Environ. Sci.: Nano, 2020,7, 1642-1651
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Olga Guselnikova,Gérard Audran,Jean-Patrick Joly,Andrii Trelin,Evgeny V. Tretyakov,Vaclav Svorcik,Oleksiy Lyutakov,Sylvain R. A. Marque Chem. Sci., 2021,12, 4154-4161
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Hanie Hashtroudi,Ian D. R. Mackinnon J. Mater. Chem. C, 2020,8, 13108-13126
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Chao-Han Cheng,Wen-Zhen Wang,Shie-Ming Peng,I-Chia Chen Phys. Chem. Chem. Phys., 2017,19, 25471-25477
-
Yiding Jiao,Liqun Kang,Jasper Berry-Gair,Kit McColl,Jianwei Li,Haobo Dong,Hao Jiang,Ryan Wang,Furio Corà,Dan J. L. Brett,Ivan P. Parkin J. Mater. Chem. A, 2020,8, 22075-22082
16397-74-3 (Cyclohexanecarboxylicacid, 2-ethylhexyl ester) Related Products
- 4630-82-4(Methyl cyclohexanecarboxylate)
- 103-23-1(Bis(2-ethylhexyl)adipate)
- 13149-00-3((3aR,7aS)-rel-Hexahydro-1,3-isobenzofurandione)
- 7452-79-1(Ethyl 2-methylbutyrate)
- 94-60-0(Dimethyl Cyclohexane-1,4-dicarboxylate(1,4-Cyclohexanedicarboxylic Dimethyl Ester))
- 2094-73-7(1-Adamantylcarboxylic Acid Ethyl Ester)
- 85-42-7(octahydro-2-benzofuran-1,3-dione)
- 14924-53-9(Ethyl cyclobutanecarboxylate)
- 1687-29-2(Dimethyl cis-1,2-Cyclohexanedicarboxylate)
- 1187-74-2(Acetonyl-succinic Acid Diethyl Ester)
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