Cas no 54699-33-1 (Decyl ethyl terephthalate)
Decyl ethyl terephthalate structure
Product Name:Decyl ethyl terephthalate
CAS No:54699-33-1
MF:C20H30O4
MW:334.449806690216
CID:2158007
PubChem ID:525166
Update Time:2025-04-21
Decyl ethyl terephthalate Chemical and Physical Properties
Names and Identifiers
-
- Decyl ethyl terephthalate
- 1,4-Benzenedicarboxylic acid 1-decyl 4-ethyl ester
- 4-O-decyl 1-O-ethyl benzene-1,4-dicarboxylate
- 54699-33-1
- Ethyl decyl terephthalate
- DB-254374
- DTXCID80286507
- SCHEMBL10332353
- 1,4-Benzenedicarboxylic acid, decyl ethyl ester
- 1-Decyl 4-ethyl terephthalate #
- Terephthalic acid, decyl ethyl ester
- DTXSID30335418
- 1-Decyl 4-ethyl terephthalate
-
- Inchi： 1S/C20H30O4/c1-3-5-6-7-8-9-10-11-16-24-20(22)18-14-12-17(13-15-18)19(21)23-4-2/h12-15H,3-11,16H2,1-2H3
- InChI Key： TXYMWKFYHOTGMH-UHFFFAOYSA-N
- SMILES： O(C(C1C=CC(C(=O)OCC)=CC=1)=O)CCCCCCCCCC
Computed Properties
- Exact Mass: 334.21440943Da
- Monoisotopic Mass: 334.21440943Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 24
- Rotatable Bond Count: 14
- Complexity: 346
- 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: 7
- Topological Polar Surface Area: 52.6?2
Decyl ethyl terephthalate Related Literature
-
Vishwesh Venkatraman,Marco Foscato,Vidar R. Jensen,Bj?rn K?re Alsberg J. Mater. Chem. A, 2015,3, 9851-9860
-
Joo Chuan Yeo,Kenry Lab Chip, 2016,16, 4082-4090
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Zhixia Liu,Tingjian Chen,Floyd E. Romesberg Chem. Sci., 2017,8, 8179-8182
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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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Chung-Sung Yang,Mong-Shian Shih,Fang-Yi Chang New J. Chem., 2006,30, 729-735
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