Cas no 6946-84-5 (Nonanedioic acid,1,9-bis(1-methylethyl) ester)
6946-84-5 structure
Product Name:Nonanedioic acid,1,9-bis(1-methylethyl) ester
Nonanedioic acid,1,9-bis(1-methylethyl) ester Chemical and Physical Properties
Names and Identifiers
-
- Nonanedioic acid,1,9-bis(1-methylethyl) ester
- diisopropyl azelate
- dipropan-2-yl nonanedioate
- AC1L3179
- AC1Q5XVZ
- AG-G-70442
- CTK5D0029
- diisopropyl azelaate
- NCIOpen2_002531
- NSC57370
- AI3-06081
- NSC 57370
- DTXSID10219626
- SCHEMBL3222966
- Nonanedioic acid, bis(1-methylethyl) ester
- NS00036859
- EINECS 230-110-6
- NSC-57370
- MCQNUBHLBYBDRS-UHFFFAOYSA-N
- 6946-84-5
-
- Inchi： 1S/C15H28O4/c1-12(2)18-14(16)10-8-6-5-7-9-11-15(17)19-13(3)4/h12-13H,5-11H2,1-4H3
- InChI Key： MCQNUBHLBYBDRS-UHFFFAOYSA-N
- SMILES： O(C(C)C)C(CCCCCCCC(=O)OC(C)C)=O
Computed Properties
- Exact Mass: 272.19884
- Monoisotopic Mass: 272.199
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 19
- Rotatable Bond Count: 12
- Complexity: 233
- 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
- Topological Polar Surface Area: 52.6A^2
- XLogP3: 3.8
Experimental Properties
- Density: 1.74
- Boiling Point: 383.2°C at 760 mmHg
- Flash Point: 185.5°C
- Refractive Index: 1.605
- PSA: 52.6
- LogP: 3.62030
Nonanedioic acid,1,9-bis(1-methylethyl) ester Related Literature
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Jason Y. C. Lim,Yong Yu,Guorui Jin,Kai Li,Yi Lu,Jianping Xie Nanoscale Adv., 2020,2, 3921-3932
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Eléonore Resongles,Corinne Casiot,Fran?oise Elbaz-Poulichet,Rémi Freydier,Odile Bruneel,Christine Piot,Sophie Delpoux,Aurélie Volant,Angélique Desoeuvre Environ. Sci.: Processes Impacts, 2013,15, 1536-1544
-
Ross Harder,David C. Dunand,Ian McNulty Nanoscale, 2017,9, 5686-5693
6946-84-5 (Nonanedioic acid,1,9-bis(1-methylethyl) ester) Related Products
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