Cas no 68084-57-1 (2-[(dodecyloxy)carbonyl]benzene-1,4-dicarboxylic acid)
![2-[(dodecyloxy)carbonyl]benzene-1,4-dicarboxylic acid structure](https://ossimg.kuujia.com/scimg/68500/68084-57-1x500.png)
68084-57-1 structure
Product Name:2-[(dodecyloxy)carbonyl]benzene-1,4-dicarboxylic acid
CAS No:68084-57-1
MF:C21H30O6
MW:378.459307193756
CID:1724336
PubChem ID:21118160
Update Time:2025-04-21
2-[(dodecyloxy)carbonyl]benzene-1,4-dicarboxylic acid Chemical and Physical Properties
Names and Identifiers
-
- 2-[(dodecyloxy)carbonyl]benzene-1,4-dicarboxylic acid
- DTXSID70887148
- DTXCID401026461
- Monolauryl trimellitate
- 1,2,4-Benzenetricarboxylic acid, monododecyl ester
- SCHEMBL25307011
- 68084-57-1
-
- Inchi： 1S/C21H30O6/c1-2-3-4-5-6-7-8-9-10-11-14-27-21(26)17-13-12-16(19(22)23)15-18(17)20(24)25/h12-13,15H,2-11,14H2,1H3,(H,22,23)(H,24,25)
- InChI Key： MQMMRCAORHXJCF-UHFFFAOYSA-N
- SMILES： O(C(C1C=CC(C(=O)O)=CC=1C(=O)O)=O)CCCCCCCCCCCC
Computed Properties
- Exact Mass: 378.2043
- Monoisotopic Mass: 378.20423867g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 6
- Heavy Atom Count: 27
- Rotatable Bond Count: 15
- Complexity: 462
- 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: 6.4
- Topological Polar Surface Area: 101?2
Experimental Properties
- Color/Form: Solid powder
- PSA: 100.9
2-[(dodecyloxy)carbonyl]benzene-1,4-dicarboxylic acid Security Information
- Signal Word：Warning
- Storage Condition：Dry, dark and store at 0-4℃ for short term (days to weeks) or -20℃ for long term (Store correctly 2-3years).
2-[(dodecyloxy)carbonyl]benzene-1,4-dicarboxylic acid Related Literature
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Guiying Zhang,Maosheng Cheng,Yanni Li,Keliang Liu,Lifeng Cai Chem. Commun., 2013,49, 11086-11088
-
Abdelaziz Houmam,Emad M. Hamed Chem. Commun., 2012,48, 11328-11330
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Ross Harder,David C. Dunand,Ian McNulty Nanoscale, 2017,9, 5686-5693
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J. Zagora,M. Vosla?,L. Schreiberová,I. Schreiber Phys. Chem. Chem. Phys., 2002,4, 1284-1291
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