Cas no 1862905-47-2 (1-Butyl-3-methyl-1H-pyrazole-4-carbonitrile)
1862905-47-2 structure
Product Name:1-Butyl-3-methyl-1H-pyrazole-4-carbonitrile
CAS No:1862905-47-2
MF:C9H13N3
MW:163.219621419907
CID:5696147
PubChem ID:130677315
Update Time:2023-10-14
1-Butyl-3-methyl-1H-pyrazole-4-carbonitrile Chemical and Physical Properties
Names and Identifiers
-
- 1862905-47-2
- EN300-1460970
- 1-Butyl-3-methyl-1H-pyrazole-4-carbonitrile
- 1H-Pyrazole-4-carbonitrile, 1-butyl-3-methyl-
-
- Inchi: 1S/C9H13N3/c1-3-4-5-12-7-9(6-10)8(2)11-12/h7H,3-5H2,1-2H3
- InChI Key: MGYTYEWJLRMROZ-UHFFFAOYSA-N
- SMILES: N1(C=C(C#N)C(C)=N1)CCCC
Computed Properties
- Exact Mass: 163.110947427g/mol
- Monoisotopic Mass: 163.110947427g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 12
- Rotatable Bond Count: 3
- Complexity: 182
- 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: 1.5
- Topological Polar Surface Area: 41.6?2
Experimental Properties
- Density: 1.02±0.1 g/cm3(Predicted)
- Boiling Point: 282.5±20.0 °C(Predicted)
- pka: -0.92±0.10(Predicted)
1-Butyl-3-methyl-1H-pyrazole-4-carbonitrile Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| Enamine | EN300-1460970-1.0g |
1-butyl-3-methyl-1H-pyrazole-4-carbonitrile |
1862905-47-2 | 1g |
$0.0 | 2023-06-06 | ||
| Enamine | EN300-1460970-50mg |
1-butyl-3-methyl-1H-pyrazole-4-carbonitrile |
1862905-47-2 | 50mg |
$660.0 | 2023-09-29 | ||
| Enamine | EN300-1460970-100mg |
1-butyl-3-methyl-1H-pyrazole-4-carbonitrile |
1862905-47-2 | 100mg |
$691.0 | 2023-09-29 | ||
| Enamine | EN300-1460970-250mg |
1-butyl-3-methyl-1H-pyrazole-4-carbonitrile |
1862905-47-2 | 250mg |
$723.0 | 2023-09-29 | ||
| Enamine | EN300-1460970-500mg |
1-butyl-3-methyl-1H-pyrazole-4-carbonitrile |
1862905-47-2 | 500mg |
$754.0 | 2023-09-29 | ||
| Enamine | EN300-1460970-1000mg |
1-butyl-3-methyl-1H-pyrazole-4-carbonitrile |
1862905-47-2 | 1000mg |
$785.0 | 2023-09-29 | ||
| Enamine | EN300-1460970-2500mg |
1-butyl-3-methyl-1H-pyrazole-4-carbonitrile |
1862905-47-2 | 2500mg |
$1539.0 | 2023-09-29 | ||
| Enamine | EN300-1460970-5000mg |
1-butyl-3-methyl-1H-pyrazole-4-carbonitrile |
1862905-47-2 | 5000mg |
$2277.0 | 2023-09-29 | ||
| Enamine | EN300-1460970-10000mg |
1-butyl-3-methyl-1H-pyrazole-4-carbonitrile |
1862905-47-2 | 10000mg |
$3376.0 | 2023-09-29 |
1-Butyl-3-methyl-1H-pyrazole-4-carbonitrile Related Literature
-
Shivani Sharma,Chia-Ming Wu,Ranjit T. Koodali,N. Rajesh RSC Adv., 2016,6, 26668-26678
-
Xingjie Wu,Linzhu Zhou,Yue Su,Chang-Ming Dong J. Mater. Chem. B, 2016,4, 2142-2152
-
Camelia Henríquez,Edwin Palacio,Víctor Cerdà Anal. Methods, 2014,6, 8494-8504
-
Chongyang Zhu,Xiaojia Bian,Xin Jia,Ning Tang,Yongqiang Cheng Food Funct., 2020,11, 10635-10644
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