Cas no 113100-46-2 (1-Butyl-3-methyl-1H-pyrazole-4-carboxylic Acid)
113100-46-2 structure
Product Name:1-Butyl-3-methyl-1H-pyrazole-4-carboxylic Acid
CAS No:113100-46-2
MF:C9H14N2O2
MW:182.219662189484
CID:3622757
PubChem ID:14277913
Update Time:2025-09-27
1-Butyl-3-methyl-1H-pyrazole-4-carboxylic Acid Chemical and Physical Properties
Names and Identifiers
-
- 1H-Pyrazole-4-carboxylic acid, 1-butyl-3-methyl-
- 1-Butyl-3-methyl-1H-pyrazole-4-carboxylic Acid
- 856-316-1
- 1-butyl-3-methyl-1H-pyrazole-4-carboxylicacid
- 113100-46-2
- G48604
- NEA10046
- AKOS010522902
- 1-BUTYL-3-METHYLPYRAZOLE-4-CARBOXYLIC ACID
- EN300-140992
- CS-0234342
- Z802545450
-
- Inchi: 1S/C9H14N2O2/c1-3-4-5-11-6-8(9(12)13)7(2)10-11/h6H,3-5H2,1-2H3,(H,12,13)
- InChI Key: NWLGJRFMXACACK-UHFFFAOYSA-N
- SMILES: N1(CCCC)C=C(C(O)=O)C(C)=N1
Computed Properties
- Exact Mass: 182.105527694Da
- Monoisotopic Mass: 182.105527694Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 13
- Rotatable Bond Count: 4
- Complexity: 184
- 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: 1.3
- Topological Polar Surface Area: 55.1?2
1-Butyl-3-methyl-1H-pyrazole-4-carboxylic Acid Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| TRC | B423470-10mg |
1-Butyl-3-methyl-1H-pyrazole-4-carboxylic Acid |
113100-46-2 | 10mg |
$ 50.00 | 2022-06-07 | ||
| TRC | B423470-50mg |
1-Butyl-3-methyl-1H-pyrazole-4-carboxylic Acid |
113100-46-2 | 50mg |
$ 210.00 | 2022-06-07 | ||
| TRC | B423470-100mg |
1-Butyl-3-methyl-1H-pyrazole-4-carboxylic Acid |
113100-46-2 | 100mg |
$ 295.00 | 2022-06-07 | ||
| Enamine | EN300-140992-0.05g |
1-butyl-3-methyl-1H-pyrazole-4-carboxylic acid |
113100-46-2 | 95.0% | 0.05g |
$100.0 | 2025-02-21 | |
| Enamine | EN300-140992-0.1g |
1-butyl-3-methyl-1H-pyrazole-4-carboxylic acid |
113100-46-2 | 95.0% | 0.1g |
$149.0 | 2025-02-21 | |
| Enamine | EN300-140992-0.25g |
1-butyl-3-methyl-1H-pyrazole-4-carboxylic acid |
113100-46-2 | 95.0% | 0.25g |
$212.0 | 2025-02-21 | |
| Enamine | EN300-140992-0.5g |
1-butyl-3-methyl-1H-pyrazole-4-carboxylic acid |
113100-46-2 | 95.0% | 0.5g |
$334.0 | 2025-02-21 | |
| Enamine | EN300-140992-1.0g |
1-butyl-3-methyl-1H-pyrazole-4-carboxylic acid |
113100-46-2 | 95.0% | 1.0g |
$428.0 | 2025-02-21 | |
| Enamine | EN300-140992-2.5g |
1-butyl-3-methyl-1H-pyrazole-4-carboxylic acid |
113100-46-2 | 95.0% | 2.5g |
$838.0 | 2025-02-21 | |
| Enamine | EN300-140992-5.0g |
1-butyl-3-methyl-1H-pyrazole-4-carboxylic acid |
113100-46-2 | 95.0% | 5.0g |
$1240.0 | 2025-02-21 |
1-Butyl-3-methyl-1H-pyrazole-4-carboxylic Acid Related Literature
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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
-
Shintaro Takata,Yoshihiro Miura Phys. Chem. Chem. Phys., 2014,16, 24784-24789
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Aloke Das,K. K. Mahato,Chayan K. Nandi,Tapas Chakraborty,Shridhar R. Gadre,Nikhil A. Gokhale Phys. Chem. Chem. Phys., 2002,4, 2162-2168
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Xing Zhao,Lu Bai,Rui-Ying Bao,Zheng-Ying Liu,Ming-Bo Yang,Wei Yang RSC Adv., 2017,7, 46297-46305
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Guang Xu,Wei Zhang,Ying Zhang,Xiaoxia Zhao,Ping Wen,Di Ma RSC Adv., 2018,8, 19353-19361
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