Cas no 7499-95-8 (11-(propanoylamino)undecanoic acid (Related Reference))
7499-95-8 structure
Product Name:11-(propanoylamino)undecanoic acid (Related Reference)
CAS No:7499-95-8
MF:C14H27NO3
MW:257.369084596634
CID:980908
PubChem ID:343661
Update Time:2025-04-19
11-(propanoylamino)undecanoic acid (Related Reference) Chemical and Physical Properties
Names and Identifiers
-
- 11-(propanoylamino)undecanoic acid (Related Reference)
- 11-(propanoylamino)undecanoic acid
- 11-propionylamino-undecanoic acid
- 11-Propionylamino-undecansaeure
- AC1L7YU2
- NSC400073
- 7499-95-8
- NSC-400073
- NSC 400073
- DTXSID30321952
- SCHEMBL20009655
-
- Inchi： 1S/C14H27NO3/c1-2-13(16)15-12-10-8-6-4-3-5-7-9-11-14(17)18/h2-12H2,1H3,(H,15,16)(H,17,18)
- InChI Key： VHNDNRBXGNSWRW-UHFFFAOYSA-N
- SMILES： OC(CCCCCCCCCCNC(CC)=O)=O
Computed Properties
- Exact Mass: 257.19921
- Monoisotopic Mass: 257.199
- 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: 3.3
- Topological Polar Surface Area: 66.4?2
Experimental Properties
- Density: 0.989
- Boiling Point: 455°C at 760 mmHg
- Flash Point: 228.9°C
- Refractive Index: 1.466
- PSA: 66.4
- LogP: 3.49900
11-(propanoylamino)undecanoic acid (Related Reference) Related Literature
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Xin Fu,Qing-rong Liang,Rong-guang Luo,Yan-shu Li,Xiao-ping Xiao,Lu-lu Yu,Wen-zhe Shan,Guang-qin Fan J. Mater. Chem. B, 2019,7, 3088-3099
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Ni-Na Sun,Fengli Qu,Xiaobing Zhang,Shufang Zhang,Jinmao You Analyst, 2015,140, 1827-1831
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Connor J. Taylor,Hikaru Seki,Friederike M. Dannheim,Mark J. Willis,Graeme Clemens,Brian A. Taylor,Thomas W. Chamberlain,Richard A. Bourne React. Chem. Eng., 2021,6, 1404-1411
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Hailing Chen,Lu Yin,Meng Liu,Laibing Wang,Michiya Fujiki,Wei Zhang RSC Adv., 2019,9, 4849-4856
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