Cas no 400077-37-4 (3,4-Isoxazoledicarboxamide,5-methyl-(9CI))
400077-37-4 structure
Product Name:3,4-Isoxazoledicarboxamide,5-methyl-(9CI)
CAS No:400077-37-4
MF:C6H7N3O3
MW:169.138080835342
MDL:MFCD01871433
CID:925159
PubChem ID:1489841
Update Time:2025-04-19
3,4-Isoxazoledicarboxamide,5-methyl-(9CI) Chemical and Physical Properties
Names and Identifiers
-
- 3,4-Isoxazoledicarboxamide,5-methyl-(9CI)
- 5-methyl-3,4-Isoxazoledicarboxamide
- 2,5-Dimethyl-isothiazolium
- 5-Methyl-isothiazol
- 5-Methylisothiazole
- 5-Methyl-isoxazol-3,4-dicarbonsaeure-diamid
- 5-methyl-isoxazole-3,4-dicarboxylic acid diamide
- Isothiazole,5-methyl
- Methyl-5 isothiazol
- Methyl-5 isothiazole
- 400077-37-4
- MFCD01871433
- 5-methylisoxazole-3,4-dicarboxamide
- 12L-920
- 5-methyl-1,2-oxazole-3,4-dicarboxamide
- AKOS005080604
- DB-069912
- Oprea1_186652
-
- MDL： MFCD01871433
- Inchi： 1S/C6H7N3O3/c1-2-3(5(7)10)4(6(8)11)9-12-2/h1H3,(H2,7,10)(H2,8,11)
- InChI Key： BNPNRCBWTDXXLP-UHFFFAOYSA-N
- SMILES： O1C(C)=C(C(N)=O)C(C(N)=O)=N1
Computed Properties
- Exact Mass: 169.04900
- Monoisotopic Mass: 169.04874109g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 12
- Rotatable Bond Count: 2
- Complexity: 218
- 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: -1.1
- Topological Polar Surface Area: 112?2
Experimental Properties
- PSA: 112.21000
- LogP: 0.58140
3,4-Isoxazoledicarboxamide,5-methyl-(9CI) Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| Chemenu | CM519596-1g |
5-Methylisoxazole-3,4-dicarboxamide |
400077-37-4 | 97% | 1g |
$347 | 2023-01-07 | |
| abcr | AB299205-100 mg |
5-Methyl-3,4-isoxazoledicarboxamide; . |
400077-37-4 | 100mg |
€221.50 | 2023-06-21 | ||
| abcr | AB299205-100mg |
5-Methyl-3,4-isoxazoledicarboxamide; . |
400077-37-4 | 100mg |
€283.50 | 2025-04-19 |
3,4-Isoxazoledicarboxamide,5-methyl-(9CI) Related Literature
-
Ross Harder,David C. Dunand,Ian McNulty Nanoscale, 2017,9, 5686-5693
-
Ivor Lon?ari? Phys. Chem. Chem. Phys., 2015,17, 9436-9445
-
Yukiya Kitayama Polym. Chem., 2014,5, 2784-2792
-
Liao Xiaoqing,Li Ruiyi,Li Zaijun,Sun Xiulan,Wang Zhouping,Liu Junkang New J. Chem., 2015,39, 5240-5248
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