Cas no 34456-22-9 (5,8-Nonadiynoic acid)
5,8-Nonadiynoic acid structure
Product Name:5,8-Nonadiynoic acid
CAS No:34456-22-9
MF:C9H10O2
MW:150.174502849579
CID:292645
PubChem ID:14428000
Update Time:2025-04-19
5,8-Nonadiynoic acid Chemical and Physical Properties
Names and Identifiers
-
- 5,8-Nonadiynoic acid
- nona-5,8-diynoic acid
- 34456-22-9
- DTXSID50560164
-
- Inchi： 1S/C9H10O2/c1-2-3-4-5-6-7-8-9(10)11/h1H,3,6-8H2,(H,10,11)
- InChI Key： QGSGBYNWNYLAMZ-UHFFFAOYSA-N
- SMILES： OC(CCCC#CCC#C)=O
Computed Properties
- Exact Mass: 150.0681
- Monoisotopic Mass: 150.068079557g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 11
- Rotatable Bond Count: 3
- Complexity: 230
- 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
- XLogP3: 1.3
- Topological Polar Surface Area: 37.3?2
Experimental Properties
- PSA: 37.3
5,8-Nonadiynoic acid Related Literature
-
José M. Rivera,Mariana Martín-Hidalgo,Jean C. Rivera-Ríos Org. Biomol. Chem., 2012,10, 7562-7565
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Haitao Li,Yu Pan,Zhizhi Wang,Shan Chen,Ruixin Guo,Jianqiu Chen RSC Adv., 2015,5, 100775-100782
-
Huabin Zhang,Shaowu Du CrystEngComm, 2014,16, 4059-4068
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Huifang Yang,Haoran Guo,Peidong Fan,Xinpan Li,Wenlu Ren,Rui Song Nanoscale, 2020,12, 7024-7034
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