Cas no 104809-65-6 (Hexanoic acid,sodium salt,N-,[1-14c])
104809-65-6 structure
Product Name:Hexanoic acid,sodium salt,N-,[1-14c]
CAS No:104809-65-6
MF:C6H11NaO2
MW:140.132654428482
CID:126464
PubChem ID:16211939
Update Time:2025-04-18
Hexanoic acid,sodium salt,N-,[1-14c] Chemical and Physical Properties
Names and Identifiers
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- Hexanoic-1-14C acid,sodium salt (9CI)
- HEXANOIC ACID, SODIUM SALT, N-, [1-14C]
- Sodium hexanoate-(carboxy-14C)
- hexanoic acid-carboxy-14C sodium
- Caproic-1-14C acid sodium salt
- HEXANOIC ACID-(CARBOXY-14C) SODIUM SALT
- 104809-65-6
- Hexanoic acid,sodium salt,N-,[1-14c]
-
- Inchi: 1S/C6H12O2.Na/c1-2-3-4-5-6(7)8;/h2-5H2,1H3,(H,7,8);/q;+1/p-1/i6+2;
- InChI Key: UDWXLZLRRVQONG-LGUBBEMLSA-M
- SMILES: [Na+].[O-][14C](CCCCC)=O
Computed Properties
- Exact Mass: 141.077
- Monoisotopic Mass: 141.077
- Isotope Atom Count: 1
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 9
- Rotatable Bond Count: 4
- Complexity: 68.9
- Covalently-Bonded Unit Count: 2
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 37.3A^2
Hexanoic acid,sodium salt,N-,[1-14c] Security Information
- Hazardous Material transportation number:UN 2910 7
- WGK Germany:3
- Hazard Category Code: 36/37/38
- Safety Instruction: 26-36
-
Hazardous Material Identification:
- Risk Phrases:36/37/38
- Safety Term:Hazard Codes XiRisk Statements 36/37/38Safety Statements 26-36RIDADR UN 2910 7WGK Germany 3
- Storage Condition:2-8°C
Hexanoic acid,sodium salt,N-,[1-14c] Related Literature
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Jing Yu,Yu-Qi Lyu,Jiapeng Liu,Mohammed B. Effat,Junxiong Wu J. Mater. Chem. A, 2019,7, 17995-18002
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Amandine Altmayer-Henzien,Valérie Declerck,David J. Aitken,Ewen Lescop,Denis Merlet,Jonathan Farjon Org. Biomol. Chem., 2013,11, 7611-7615
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Qiao Song,Angela Bamesberger,Lingyun Yang,Haley Houtwed,Haishi Cao Analyst, 2014,139, 3588-3592
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Zhixia Liu,Tingjian Chen,Floyd E. Romesberg Chem. Sci., 2017,8, 8179-8182
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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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