Cas no 35261-03-1 (4-Isoxazolecarbonitrile,5-amino-3-(1-methylethyl)-)
35261-03-1 structure
Product Name:4-Isoxazolecarbonitrile,5-amino-3-(1-methylethyl)-
CAS No:35261-03-1
MF:C7H9N3O
MW:151.165860891342
CID:295515
PubChem ID:45095847
Update Time:2025-09-22
4-Isoxazolecarbonitrile,5-amino-3-(1-methylethyl)- Chemical and Physical Properties
Names and Identifiers
-
- 4-Isoxazolecarbonitrile,5-amino-3-(1-methylethyl)-
- 4-Isoxazolecarbonitrile,5-amino-3-(1-methylethyl)-(9CI)
- 5-Amino-3-isopropylisoxazole-4-carbonitrile
- AKOS022060313
- 35261-03-1
-
- Inchi： 1S/C7H9N3O/c1-4(2)6-5(3-8)7(9)11-10-6/h4H,9H2,1-2H3
- InChI Key： RNIWZGAXJBDTSY-UHFFFAOYSA-N
- SMILES： O1C(=C(C#N)C(C(C)C)=N1)N
Computed Properties
- Exact Mass: 151.07467
- Monoisotopic Mass: 151.075
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 11
- Rotatable Bond Count: 1
- Complexity: 183
- 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: 75.8A^2
- XLogP3: 1.5
Experimental Properties
- PSA: 75.84
4-Isoxazolecarbonitrile,5-amino-3-(1-methylethyl)- Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| Chemenu | CM518777-1g |
5-Amino-3-isopropylisoxazole-4-carbonitrile |
35261-03-1 | 97% | 1g |
$637 | 2023-01-07 |
4-Isoxazolecarbonitrile,5-amino-3-(1-methylethyl)- Related Literature
-
Haitao Li,Yu Pan,Zhizhi Wang,Shan Chen,Ruixin Guo,Jianqiu Chen RSC Adv., 2015,5, 100775-100782
-
Kaiyuan Huang,Wangkang Qiu,Meilian Ou,Xiaorui Liu,Zenan Liao,Sheng Chu RSC Adv., 2020,10, 18824-18829
-
Andre Prates Pereira,Tao Dong,Eric P. Knoshaug,Nick Nagle,Ryan Spiller,Bonnie Panczak,Christopher J. Chuck,Philip T. Pienkos Sustainable Energy Fuels, 2020,4, 3400-3408
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