Cas no 111109-95-6 (Butanoic acid, 4-[(1-oxodecyl)amino]-)
![Butanoic acid, 4-[(1-oxodecyl)amino]- structure](https://ossimg.kuujia.com/scimg/111500/111109-95-6x500.png)
111109-95-6 structure
Product Name:Butanoic acid, 4-[(1-oxodecyl)amino]-
CAS No:111109-95-6
MF:C14H27NO3
MW:257.369084596634
CID:1196319
PubChem ID:43355126
Update Time:2025-04-20
Butanoic acid, 4-[(1-oxodecyl)amino]- Chemical and Physical Properties
Names and Identifiers
-
- Butanoic acid, 4-[(1-oxodecyl)amino]-
- 4-(decanoylamino)butanoic acid
- 4-Decanamidobutanoic acid
- UNII-H321SQ587P
- Butanoic acid, 4-((1-oxodecyl)amino)-
- Q27279574
- SCHEMBL15297165
- H321SQ587P
- XNG
- 111109-95-6
- DTXSID60655919
-
- Inchi： 1S/C14H27NO3/c1-2-3-4-5-6-7-8-10-13(16)15-12-9-11-14(17)18/h2-12H2,1H3,(H,15,16)(H,17,18)
- InChI Key： BARYBGIAWGGBOE-UHFFFAOYSA-N
- SMILES： O=C(CCCCCCCCC)NCCCC(=O)O
Computed Properties
- Exact Mass: 257.19921
- Monoisotopic Mass: 257.19909372g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 18
- Rotatable Bond Count: 12
- Complexity: 229
- 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: 3.5
- Topological Polar Surface Area: 66.4?2
Experimental Properties
- PSA: 66.4
Butanoic acid, 4-[(1-oxodecyl)amino]- Related Literature
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Quan Xiang,Yiqin Chen,Zhiqin Li,Kaixi Bi,Guanhua Zhang,Huigao Duan Nanoscale, 2016,8, 19541-19550
-
Huabin Zhang,Shaowu Du CrystEngComm, 2014,16, 4059-4068
-
Alvin Tanudjaja,Shinsuke Inagi,Fusao Kitamura,Toshikazu Takata,Ikuyoshi Tomita Dalton Trans., 2021,50, 3037-3043
-
Robert J. Meagher,Anson V. Hatch,Ronald F. Renzi,Anup K. Singh Lab Chip, 2008,8, 2046-2053
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Teresita Carrillo-Hernández,Philippe Schaeffer,Pierre Albrecht Chem. Commun., 2001, 1976-1977
111109-95-6 (Butanoic acid, 4-[(1-oxodecyl)amino]-) Related Products
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- 1270529-38-8(1,2,3,4,5,6-Hexahydro-[2,3]bipyridinyl-6-ol)
- 2680771-01-9(4-cyclopentyl-3-{(prop-2-en-1-yloxy)carbonylamino}butanoic acid)
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