Cas no 894789-43-6 (6-fluoro-1,2-benzoxazole-3-carboxylic acid)
894789-43-6 structure
Product Name:6-fluoro-1,2-benzoxazole-3-carboxylic acid
CAS No:894789-43-6
MF:C8H4FNO3
MW:181.120665550232
MDL:MFCD09027539
CID:714766
PubChem ID:55253689
Update Time:2025-04-19
6-fluoro-1,2-benzoxazole-3-carboxylic acid Chemical and Physical Properties
Names and Identifiers
-
- 1,2-Benzisoxazole-3-carboxylicacid, 6-fluoro-
- 6-FLUOROBENZO[D]ISOXAZOLE-3-CARBOXYLIC ACID
- 894789-43-6
- SCHEMBL13576767
- DTXSID70716984
- CS-0145326
- J-518743
- MFCD09027539
- AS-43717
- EN300-306499
- 6-fluoro-1,2-benzoxazole-3-carboxylic acid
- Z2582143681
- AKOS006288594
-
- MDL： MFCD09027539
- Inchi： 1S/C8H4FNO3/c9-4-1-2-5-6(3-4)13-10-7(5)8(11)12/h1-3H,(H,11,12)
- InChI Key： HROCHLQLWNRYQX-UHFFFAOYSA-N
- SMILES： FC1C=CC2C(C(=O)O)=NOC=2C=1
Computed Properties
- Exact Mass: 181.01800
- Monoisotopic Mass: 181.018
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 13
- Rotatable Bond Count: 1
- Complexity: 223
- 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
- Surface Charge: 0
- Tautomer Count: nothing
- XLogP3: 1.7
- Topological Polar Surface Area: 63.3A^2
Experimental Properties
- PSA: 63.33000
- LogP: 1.66510
6-fluoro-1,2-benzoxazole-3-carboxylic acid Security Information
- Signal Word：warning
- Hazard Statement： H303May be harmful if swallowed+H313Skin contact may be harmful+H333Inhalation may be harmful to the body
- Warning Statement： P264+P280+P305+P351+P338+P337+P313
- Safety Instruction： H303+H313+H333
- Storage Condition：storage at -4℃ (1-2weeks), longer storage period at -20℃ (1-2years)
6-fluoro-1,2-benzoxazole-3-carboxylic acid Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| Chemenu | CM528200-1g |
6-Fluorobenzo[d]isoxazole-3-carboxylic acid |
894789-43-6 | 97% | 1g |
$*** | 2023-05-29 | |
| TRC | B440960-10mg |
6-fluoro-1,2-benzoxazole-3-carboxylic acid |
894789-43-6 | 10mg |
$ 70.00 | 2022-06-07 | ||
| TRC | B440960-50mg |
6-fluoro-1,2-benzoxazole-3-carboxylic acid |
894789-43-6 | 50mg |
$ 250.00 | 2022-06-07 | ||
| TRC | B440960-100mg |
6-fluoro-1,2-benzoxazole-3-carboxylic acid |
894789-43-6 | 100mg |
$ 365.00 | 2022-06-07 | ||
| Enamine | EN300-306499-0.05g |
6-fluoro-1,2-benzoxazole-3-carboxylic acid |
894789-43-6 | 95.0% | 0.05g |
$245.0 | 2025-03-19 | |
| Enamine | EN300-306499-0.1g |
6-fluoro-1,2-benzoxazole-3-carboxylic acid |
894789-43-6 | 95.0% | 0.1g |
$364.0 | 2025-03-19 | |
| Enamine | EN300-306499-0.25g |
6-fluoro-1,2-benzoxazole-3-carboxylic acid |
894789-43-6 | 95.0% | 0.25g |
$520.0 | 2025-03-19 | |
| Enamine | EN300-306499-0.5g |
6-fluoro-1,2-benzoxazole-3-carboxylic acid |
894789-43-6 | 95.0% | 0.5g |
$818.0 | 2025-03-19 | |
| Enamine | EN300-306499-1.0g |
6-fluoro-1,2-benzoxazole-3-carboxylic acid |
894789-43-6 | 95.0% | 1.0g |
$1049.0 | 2025-03-19 | |
| Enamine | EN300-306499-2.5g |
6-fluoro-1,2-benzoxazole-3-carboxylic acid |
894789-43-6 | 95.0% | 2.5g |
$2203.0 | 2025-03-19 |
6-fluoro-1,2-benzoxazole-3-carboxylic acid Related Literature
-
Xingqun Zheng,Lele Song,Xin Feng,Li Li,Zidong Wei J. Mater. Chem. A, 2020,8, 14145-14151
-
Jason Y. C. Lim,Yong Yu,Guorui Jin,Kai Li,Yi Lu,Jianping Xie Nanoscale Adv., 2020,2, 3921-3932
-
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
-
Denis V. Korchagin,Elena A. Yureva,Alexander V. Akimov,Eugenii Ya. Misochko,Gennady V. Shilov,Artem D. Talantsev,Roman B. Morgunov,Alexander A. Shakin,Sergey M. Aldoshin,Boris S. Tsukerblat Dalton Trans., 2017,46, 7540-7548
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