Cas no 199529-12-9 (2-fluoro-5-hydroxyterephthalonitrile)
199529-12-9 structure
Product Name:2-fluoro-5-hydroxyterephthalonitrile
CAS No:199529-12-9
MF:C8H3FN2O
MW:162.120624780655
CID:908711
Update Time:2024-06-15
2-fluoro-5-hydroxyterephthalonitrile Chemical and Physical Properties
Names and Identifiers
-
- 2-fluoro-5-hydroxyterephthalonitrile
- 1,4-Benzenedicarbonitrile,2-fluoro-5-hydroxy-(9CI)
- 1,4-Benzenedicarbonitrile, 2-fluoro-5-hydroxy-
-
- Inchi： 1S/C8H3FN2O/c9-7-1-6(4-11)8(12)2-5(7)3-10/h1-2,12H
- InChI Key： VJKWFGPWZVUFIB-UHFFFAOYSA-N
- SMILES： C1(C#N)=CC(O)=C(C#N)C=C1F
Computed Properties
- Exact Mass: 162.02299
- Monoisotopic Mass: 162.023
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 12
- Rotatable Bond Count: 0
- Complexity: 261
- 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
- Topological Polar Surface Area: 67.8A^2
Experimental Properties
- Density: 1.44±0.1 g/cm3(Predicted)
- Boiling Point: 353.3±42.0 °C(Predicted)
- PSA: 67.81
- pka: 5.81±0.23(Predicted)
2-fluoro-5-hydroxyterephthalonitrile Related Literature
-
Yukiya Kitayama Polym. Chem., 2014,5, 2784-2792
-
Norihito Fukui,Keisuke Fujimoto,Hideki Yorimitsu,Atsuhiro Osuka Dalton Trans., 2017,46, 13322-13341
-
Jason Wan Lab Chip, 2020,20, 4528-4538
-
Kay S. McMillan,Anthony G. McCluskey,Annette Sorensen,Marie Boyd,Michele Zagnoni Analyst, 2016,141, 100-110
-
Ji-Ping Wei Nanoscale, 2015,7, 11815-11832
199529-12-9 (2-fluoro-5-hydroxyterephthalonitrile) Related Products
- 140675-43-0(2-Fluoro-6-hydroxybenzonitrile)
- 221202-36-4(Benzonitrile,2,3-difluoro-6-hydroxy-)
- 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)
- 1444113-98-7(N-(3-cyanothiolan-3-yl)-2-[(2,2,2-trifluoroethyl)sulfanyl]pyridine-4-carboxamide)
- 941977-17-9(N'-(3-chloro-2-methylphenyl)-N-2-(dimethylamino)-2-(naphthalen-1-yl)ethylethanediamide)
- 2138166-62-6(2,2-Difluoro-3-[methyl(2-methylbutyl)amino]propanoic acid)
- 89640-58-4(2-Iodo-4-nitrophenylhydrazine)
Recommended suppliers
Shanghai Pearlk Chemicals Co., Ltd.
Gold Member
Audited Supplier
CN Supplier
Bulk
Shenzhen GeneSeqTools Bioscience & Technology Co. Ltd.
Gold Member
Audited Supplier
CN Supplier
Reagent
Amadis Chemical Company Limited
Gold Member
Audited Supplier
CN Supplier
Reagent
Jinta Yudi Pharmaceutical Technology Co., Ltd.
Gold Member
Audited Supplier
CN Supplier
Bulk
Shanghai Jinhuan Chemical CO., LTD.
Gold Member
Audited Supplier
CN Supplier
Bulk
