Cas no 221202-36-4 (Benzonitrile,2,3-difluoro-6-hydroxy-)
221202-36-4 structure
Product Name:Benzonitrile,2,3-difluoro-6-hydroxy-
CAS No:221202-36-4
MF:C7H3F2NO
MW:155.101628541946
MDL:MFCD10574786
CID:244186
PubChem ID:23448364
Update Time:2025-04-19
Benzonitrile,2,3-difluoro-6-hydroxy- Chemical and Physical Properties
Names and Identifiers
-
- Benzonitrile,2,3-difluoro-6-hydroxy-
- 2,3-DIFLUORO-6-HYDROXY-BENZONITRILE
- 2,3-Difluoro-6-hydroxybenzonitrile
- LogP
- MFCD10574786
- SCHEMBL6736322
- AKOS006305740
- CS-0373245
- 221202-36-4
- AT10513
- Benzonitrile, 2,3-difluoro-6-hydroxy- (9CI)
-
- MDL： MFCD10574786
- Inchi： 1S/C7H3F2NO/c8-5-1-2-6(11)4(3-10)7(5)9/h1-2,11H
- InChI Key： RBEFTDOWLXTNFB-UHFFFAOYSA-N
- SMILES： FC1=C(C=CC(=C1C#N)O)F
Computed Properties
- Exact Mass: 155.01829
- Monoisotopic Mass: 155.018
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 11
- Rotatable Bond Count: 0
- Complexity: 188
- 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: 44A^2
- XLogP3: 2
Experimental Properties
- Density: 1.45
- Boiling Point: 270.64°C at 760 mmHg
- Flash Point: 117.479°C
- Refractive Index: 1.53
- PSA: 44.02
Benzonitrile,2,3-difluoro-6-hydroxy- Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| abcr | AB503643-100 mg |
2,3-Difluoro-6-hydroxy-benzonitrile; . |
221202-36-4 | 100MG |
€165.00 | 2023-04-18 | ||
| abcr | AB503643-100mg |
2,3-Difluoro-6-hydroxy-benzonitrile; . |
221202-36-4 | 100mg |
€165.00 | 2025-02-16 |
Benzonitrile,2,3-difluoro-6-hydroxy- Related Literature
-
Erika A. Cobar,Paul R. Horn,Robert G. Bergman,Martin Head-Gordon Phys. Chem. Chem. Phys., 2012,14, 15328-15339
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Alexandre Vimont,Arnaud Travert,Philippe Bazin,Jean-Claude Lavalley,Marco Daturi,Christian Serre,Gérard Férey,Sandrine Bourrelly,Philip L. Llewellyn Chem. Commun., 2007, 3291-3293
-
Liao Xiaoqing,Li Ruiyi,Li Zaijun,Sun Xiulan,Wang Zhouping,Liu Junkang New J. Chem., 2015,39, 5240-5248
-
Andreas Nenning,Manuel Holzmann,Jürgen Fleig,Alexander K. Opitz Mater. Adv., 2021,2, 5422-5431
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