Cas no 109273-63-4 (2-Propynoic acid, 2-butynyl ester)
109273-63-4 structure
Product Name:2-Propynoic acid, 2-butynyl ester
CAS No:109273-63-4
MF:C7H6O2
MW:122.121342182159
CID:1188499
PubChem ID:13703874
Update Time:2025-04-20
2-Propynoic acid, 2-butynyl ester Chemical and Physical Properties
Names and Identifiers
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- 2-Propynoic acid, 2-butynyl ester
- But-2-yn-1-yl prop-2-ynoate
- InChI=1/C7H6O2/c1-3-5-6-9-7(8)4-2/h2H,6H2,1H
- DTXSID10547153
- 109273-63-4
-
- Inchi： 1S/C7H6O2/c1-3-5-6-9-7(8)4-2/h2H,6H2,1H3
- InChI Key： WOKKCJBCWDOUCU-UHFFFAOYSA-N
- SMILES： O(C(C#C)=O)CC#CC
Computed Properties
- Exact Mass: 122.03678
- Monoisotopic Mass: 122.036779430g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 9
- Rotatable Bond Count: 2
- Complexity: 205
- 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: 1.2
- Topological Polar Surface Area: 26.3?2
Experimental Properties
- PSA: 26.3
2-Propynoic acid, 2-butynyl ester Related Literature
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Gang Pan,Yi-jie Bao,Jie Xu,Tao Liu,Cheng Liu,Yan-yan Qiu,Xiao-jing Shi,Hui Yu,Ting-ting Jia,Xia Yuan,Ze-ting Yuan,Yi-jun Cao RSC Adv., 2016,6, 42109-42119
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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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Liao Xiaoqing,Li Ruiyi,Li Zaijun,Sun Xiulan,Wang Zhouping,Liu Junkang New J. Chem., 2015,39, 5240-5248
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Christopher B. Rodell,Christopher B. Highley,Minna H. Chen,Neville N. Dusaj,Chao Wang,Lin Han,Jason A. Burdick Soft Matter, 2016,12, 7839-7847
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Bo Wei,Zhenyu Liu,Chen Xie,Shu Yang,Wentao Tang,Aiwei Gu,Wing-Tak Wong,Ka-Leung Wong J. Mater. Chem. C, 2015,3, 12322-12327
109273-63-4 (2-Propynoic acid, 2-butynyl ester) Related Products
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- 4341-76-8(ethyl but-2-ynoate)
- 623-47-2(ethyl propiolate)
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- 34485-37-5(2-Butynyl acetate,98%)
- 31555-04-1(2-Butynoic acid, 4-hydroxy-, ethyl ester)
- 332062-08-5(Fmoc-S-3-amino-4,4-diphenyl-butyric acid)
- 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)
- 2098070-20-1(2-(3-(Pyridin-3-yl)-1H-pyrazol-1-yl)acetimidamide)
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