Cas no 214552-85-9 (Benzene,1-(3-buten-1-yn-1-yl)-4-fluoro-)
214552-85-9 structure
Product Name:Benzene,1-(3-buten-1-yn-1-yl)-4-fluoro-
CAS No:214552-85-9
MF:C10H7F
MW:146.160986185074
CID:242908
PubChem ID:10975626
Update Time:2025-04-19
Benzene,1-(3-buten-1-yn-1-yl)-4-fluoro- Chemical and Physical Properties
Names and Identifiers
-
- Benzene,1-(3-buten-1-yn-1-yl)-4-fluoro-
- 1-but-3-en-1-ynyl-4-fluorobenzene
- 4-(4-Fluorophenyl)-1-buten-3-yne
- Benzene,1-(3-buten-1-ynyl)-4-fluoro- (9CI)
- 214552-85-9
- DTXSID50450354
- SCHEMBL18375968
- 1-(But-3-en-1-yn-1-yl)-4-fluorobenzene
- 1-but-3-en-1-ynyl-4-fluoro-benzene
-
- Inchi： 1S/C10H7F/c1-2-3-4-9-5-7-10(11)8-6-9/h2,5-8H,1H2
- InChI Key： NPJLHJWYDPGYOI-UHFFFAOYSA-N
- SMILES： FC1C=CC(C#CC=C)=CC=1
Computed Properties
- Exact Mass: 146.05321
- Monoisotopic Mass: 146.053178385g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 11
- Rotatable Bond Count: 1
- Complexity: 185
- 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: 3.2
- Topological Polar Surface Area: 0?2
Experimental Properties
- PSA: 0
Benzene,1-(3-buten-1-yn-1-yl)-4-fluoro- Related Literature
-
Xinhuan Wang,Shuangfei Cai,Cui Qi Analyst, 2017,142, 2500-2506
-
Partha Laskar,Christine Dufès Nanoscale Adv., 2021,3, 6007-6026
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Hongxia Li,Aikifa Raza,Qiaoyu Ge,Jin-You Lu,TieJun Zhang Soft Matter, 2020,16, 6841-6849
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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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