Cas no 856343-97-0 (Methyl 1,4-dimethyl-1H-pyrazole-5-carboxylate)
856343-97-0 structure
Product Name:Methyl 1,4-dimethyl-1H-pyrazole-5-carboxylate
CAS No:856343-97-0
MF:C7H10N2O2
MW:154.166501522064
CID:2116377
Update Time:2023-08-04
Methyl 1,4-dimethyl-1H-pyrazole-5-carboxylate Chemical and Physical Properties
Names and Identifiers
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- methyl 1,4-dimethyl-1H-pyrazole-5-carboxylate
- CVYXYKIGEFNVQQ-UHFFFAOYSA-N
- 1H-Pyrazole-5-carboxylic acid, 1,4-dimethyl-, methyl ester
- Methyl 1,4-dimethyl-1H-pyrazole-5-carboxylate
-
- Inchi： 1S/C7H10N2O2/c1-5-4-8-9(2)6(5)7(10)11-3/h4H,1-3H3
- InChI Key： CVYXYKIGEFNVQQ-UHFFFAOYSA-N
- SMILES： O(C)C(C1=C(C)C=NN1C)=O
Computed Properties
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 11
- Rotatable Bond Count: 2
- Complexity: 161
- Topological Polar Surface Area: 44.1
Methyl 1,4-dimethyl-1H-pyrazole-5-carboxylate Related Literature
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Yingbo Li,Nada Mehio,Huizhou Liu,Sheng Dai Green Chem., 2015,17, 2981-2993
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Ying Li,Weirong Yao,Yunfei Xie,Renjun Pei RSC Adv., 2015,5, 98724-98729
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Jing Chen,Yu Shao,Danzhen Li J. Mater. Chem. A, 2017,5, 937-941
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Jieun Kim,Han-Saem Park,Tae-Hee Kim,Sung Yeol Kim,Hyun-Kon Song Phys. Chem. Chem. Phys., 2014,16, 5295-5300
856343-97-0 (Methyl 1,4-dimethyl-1H-pyrazole-5-carboxylate) Related Products
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