Cas no 63317-99-7 (5,9-Hexadecadienoicacid)
5,9-Hexadecadienoicacid structure
Product Name:5,9-Hexadecadienoicacid
CAS No:63317-99-7
MF:C16H28O2
MW:252.392325401306
CID:519109
Update Time:2025-04-19
5,9-Hexadecadienoicacid Chemical and Physical Properties
Names and Identifiers
-
- 5,9-Hexadecadienoicacid
- hexadeca-5,9-dienoic acid
-
- Inchi： 1S/C16H28O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16(17)18/h7-8,11-12H,2-6,9-10,13-15H2,1H3,(H,17,18)/b8-7+,12-11+
- InChI Key： FHLHSNNZRDBQGE-NJHWEWLZSA-N
- SMILES： CCCCCC/C=C/CC/C=C/CCCC(=O)O
Computed Properties
- Exact Mass: 252.20904
- Monoisotopic Mass: 252.20893
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 18
- Rotatable Bond Count: 12
- Complexity: 242
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 2
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 37.3
Experimental Properties
- Density: 0.919
- Boiling Point: 346.6°C at 760 mmHg
- Flash Point: 243.6°C
- Refractive Index: 1.479
- PSA: 37.3
5,9-Hexadecadienoicacid Related Literature
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Bidyut Kumar Kundu,Rinky Singh,Ritudhwaj Tiwari,Debasis Nayak New J. Chem., 2019,43, 4867-4877
-
Karl Crowley,Eimer O'Malley,Aoife Morrin,Malcolm R. Smyth,Anthony J. Killard Analyst, 2008,133, 391-399
-
Cheng Fang,Jinjian Wu,Zahra Sobhani,Md. Al Amin,Youhong Tang Anal. Methods, 2019,11, 163-170
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