Cas no 141-13-9 (9-Undecenal,2,6,10-trimethyl-)
9-Undecenal,2,6,10-trimethyl- structure
Product Name:9-Undecenal,2,6,10-trimethyl-
CAS No:141-13-9
MF:C14H26O
MW:210.355644702911
CID:165660
Update Time:2025-04-19
9-Undecenal,2,6,10-trimethyl- Chemical and Physical Properties
Names and Identifiers
-
- 9-Undecenal,2,6,10-trimethyl-
- 2,6,10-trimethylundec-9-enal
- 2,4-DIPHENYLBENZOFURAN
- 2,6,10-Trimethyl-9-undecen-1-al
- 9-Undecenal,2,6,10-trimethyl
- EINECS 205-460-8
- 2,6,10-trimethyl-9-undecena
- doxal
- farenal
- trimethyl undecylenic aldehyde
- ADOXAL
- ADOXAL NP
- FARENAL H+R
- 2,6,10-trimethyl-9-Undecenal
- TRMETHYL UNDECYLENIC ALDEHYDE
- trimethylundecylenicaldehyde
-
- Inchi： 1S/C14H26O/c1-12(2)7-5-8-13(3)9-6-10-14(4)11-15/h7,11,13-14H,5-6,8-10H2,1-4H3
- InChI Key： UEGBWDUVDAKUGA-UHFFFAOYSA-N
- SMILES： C(C)(CC/C=C(/C)\C)CCCC(C)C=O
Computed Properties
- Exact Mass: 210.19800
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 15
- Rotatable Bond Count: 8
- Complexity: 190
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 2
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Surface Charge: 0
- Tautomer Count: 2
- XLogP3: 5
Experimental Properties
- Density: 0.8534 (estimate)
- Melting Point: 15°C (estimate)
- Boiling Point: 299.9°C (estimate)
- Refractive Index: 1.4557 (estimate)
- PSA: 17.07000
- LogP: 4.37420
- FEMA: 4768 | 2,6,10-TRIMETHYL-9-UNDECENAL
9-Undecenal,2,6,10-trimethyl- Related Literature
-
Federico M. Ferrero Vallana,Ricardo P. Girling,H. Q. Nimal Gunaratne,Lynette A. M. Holland,Pauline M. Mcnamee,Kenneth R. Seddon,Jonathan R. Stonehouse,Oreste Todini New J. Chem. 2016 40 9958
-
Diana Visinescu,Maria-Gabriela Alexandru,Augustin M. Madalan,Ie-Rang Jeon,Corine Mathonière,Rodolphe Clérac,Marius Andruh Dalton Trans. 2016 45 7642
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