Cas no 45298-06-4 (2-Butenedioic acid(2Z)-, didecyl ester (9CI))
45298-06-4 structure
Product Name:2-Butenedioic acid(2Z)-, didecyl ester (9CI)
CAS No:45298-06-4
MF:C24H44O4
MW:396.603768348694
CID:330834
PubChem ID:5354345
Update Time:2025-04-19
2-Butenedioic acid(2Z)-, didecyl ester (9CI) Chemical and Physical Properties
Names and Identifiers
-
- 2-Butenedioic acid(2Z)-, didecyl ester (9CI)
- didecyl but-2-enedioate
- Bis(1-decyl) maleate
- NS00057156
- 2-Butenedioic acid (Z)-, didecyl ester
- DTXSID101303268
- NSC6736
- didecyl (Z)-but-2-enedioate
- AI3-22479
- Maleic acid, didecyl ester
- 1,4-Didecyl (2Z)-2-butenedioate
- 45298-06-4
- 2-Butenedioic acid, (Z)-, didecyl ester
- SCHEMBL629797
- NSC-6736
- EINECS 256-226-7
- Didecyl maleate
-
- Inchi： 1S/C24H44O4/c1-3-5-7-9-11-13-15-17-21-27-23(25)19-20-24(26)28-22-18-16-14-12-10-8-6-4-2/h19-20H,3-18,21-22H2,1-2H3/b20-19-
- InChI Key： BVVRPLNLVUMGSL-VXPUYCOJSA-N
- SMILES： O(C(/C=C\C(=O)OCCCCCCCCCC)=O)CCCCCCCCCC
Computed Properties
- Exact Mass: 396.32396
- Monoisotopic Mass: 396.32396
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 28
- Rotatable Bond Count: 22
- Complexity: 354
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 1
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 52.6
- XLogP3: 9.2
Experimental Properties
- Density: 0.932±0.06 g/cm3 (20 oC 760 Torr),
- Boiling Point: 471.7°Cat760mmHg
- Flash Point: 221.3°C
- Refractive Index: 1.4521 (25 oC)
- Solubility: Insuluble (9.5E-5 g/L) (25 oC),
2-Butenedioic acid(2Z)-, didecyl ester (9CI) Related Literature
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R. M. Pemberton,J. P. Hart,T. T. Mottram Analyst, 2001,126, 1866-1871
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Suji Lee,Min Su Han Chem. Commun., 2021,57, 9450-9453
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James D. Kirkham,Patrick M. Delaney,George J. Ellames,Eleanor C. Row,Joseph P. A. Harrity Chem. Commun., 2010,46, 5154-5156
-
Haitao Li,Yu Pan,Zhizhi Wang,Shan Chen,Ruixin Guo,Jianqiu Chen RSC Adv., 2015,5, 100775-100782
-
Christian K. Rank,Alexander W. Jones,Tatjana Wall,Patrick Di Martino-Fumo,Sarah Schr?ck,Markus Gerhards,Frederic W. Patureau Chem. Commun., 2019,55, 13749-13752
45298-06-4 (2-Butenedioic acid(2Z)-, didecyl ester (9CI)) Related Products
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