Cas no 108419-35-8 (Acetic acid,C11-14-branched alkyl esters, C13-rich)
108419-35-8 structure
Product Name:Acetic acid,C11-14-branched alkyl esters, C13-rich
CAS No:108419-35-8
MF:C15H30O2
MW:242.397505283356
CID:219928
PubChem ID:22833468
Update Time:2025-04-19
Acetic acid,C11-14-branched alkyl esters, C13-rich Chemical and Physical Properties
Names and Identifiers
-
- Acetic acid,C11-14-branched alkyl esters, C13-rich
- (3,4-diethyl-6-methyloctyl) acetate
- ACETIC ACID, ALKYL (C11 TO C14) ESTERS MIXTURE
- 3,4-diethyl-6-methyloctyl acetate
- Acetic acid, C11-14 branched, alkyl ester
- C13-Rich C11-14-branched alkyl acetates
- OXOTRIDECYLACETATE
- polymethylolacetate
- OXO-ALCOHOL ACETIC ACID ESTER
- aceticacid,c11-14-branchedalkylesters,c13-rich
- C11-14-alkyl acetates, branched, tridecyl acetate-rich
- SCHEMBL15437868
- 108419-35-8
- DTXSID20880588
-
- Inchi： 1S/C15H30O2/c1-6-12(4)11-15(8-3)14(7-2)9-10-17-13(5)16/h12,14-15H,6-11H2,1-5H3
- InChI Key： UCXBDUCHMOVNPF-UHFFFAOYSA-N
- SMILES： O(C(C)=O)CCC(CC)C(CC)CC(C)CC
Computed Properties
- Exact Mass: 242.2247
- Monoisotopic Mass: 242.225
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 17
- Rotatable Bond Count: 10
- Complexity: 201
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 3
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 26.3A^2
- XLogP3: 5.6
Experimental Properties
- Density: 0.875?g/mL?at 25?°C(lit.)
- Boiling Point: 240-285?°C(lit.)
- Flash Point: 113?°C
- Refractive Index: n20/D 1.438(lit.)
- PSA: 26.3
Acetic acid,C11-14-branched alkyl esters, C13-rich Related Literature
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Daniel Messmer,Stefan Salentinig,Jakob Heier Nanoscale, 2019,11, 6929-6938
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Saeideh Mirfakhraei,Malak Hekmati,Fereshteh Hosseini Eshbala,Hojat Veisi New J. Chem., 2018,42, 1757-1761
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Dan Yang,Yanping Zhou,Xianhong Rui,Jixin Zhu,Ziyang Lu,Eileen Fong,Qingyu Yan RSC Adv., 2013,3, 14960-14962
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Partha Laskar,Christine Dufès Nanoscale Adv., 2021,3, 6007-6026
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Weili Dai,Guangjun Wu,Michael Hunger Chem. Commun., 2015,51, 13779-13782
108419-35-8 (Acetic acid,C11-14-branched alkyl esters, C13-rich) Related Products
- 6963-44-6(1,5-Diacetoxypentane)
- 624-41-9(Aceticacidmethylbutylester; 98%)
- 6222-17-9(Hexanedioldiacetate)
- 112-14-1(Octyl acetate)
- 112-17-4(Decyl acetate)
- 123-92-2(Isoamyl acetate)
- 1072-33-9(Tridecyl acetate)
- 103-09-3(2-Ethylhexyl acetate)
- 112-06-1(Heptyl acetate)
- 332062-08-5(Fmoc-S-3-amino-4,4-diphenyl-butyric acid)
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