Cas no 857640-31-4 (5-CHLORO-3-(3,4-DIMETHOXYPHENYL)-1-METHYL-1H-PYRAZOLE-4-METHANOL)
857640-31-4 structure
Product Name:5-CHLORO-3-(3,4-DIMETHOXYPHENYL)-1-METHYL-1H-PYRAZOLE-4-METHANOL
CAS No:857640-31-4
MF:C13H15ClN2O3
MW:282.722802400589
CID:878790
Update Time:2023-03-27
5-CHLORO-3-(3,4-DIMETHOXYPHENYL)-1-METHYL-1H-PYRAZOLE-4-METHANOL Chemical and Physical Properties
Names and Identifiers
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- 5-CHLORO-3-(3,4-DIMETHOXYPHENYL)-1-METHYL-1H-PYRAZOLE-4-METHANOL
- 1H-Pyrazole-4-methanol, 5-chloro-3-(3,4-dimethoxyphenyl)-1-methyl-
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- Inchi： 1S/C13H15ClN2O3/c1-16-13(14)9(7-17)12(15-16)8-4-5-10(18-2)11(6-8)19-3/h4-6,17H,7H2,1-3H3
- InChI Key： IVRHUZUZQNRSKG-UHFFFAOYSA-N
- SMILES： N1(C)C(Cl)=C(CO)C(C2=CC=C(OC)C(OC)=C2)=N1
Computed Properties
- Exact Mass: 282.077
- Monoisotopic Mass: 282.077
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 19
- Rotatable Bond Count: 4
- Complexity: 295
- 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
5-CHLORO-3-(3,4-DIMETHOXYPHENYL)-1-METHYL-1H-PYRAZOLE-4-METHANOL Related Literature
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H. V. Jain,D. Verthelyi,S. L. Beaucage RSC Adv., 2017,7, 42519-42528
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Kanjun Sun,Fengting Hua,Shuzhen Cui,Yanrong Zhu,Hui Peng,Guofu Ma RSC Adv., 2021,11, 37631-37642
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Huifang Yang,Haoran Guo,Peidong Fan,Xinpan Li,Wenlu Ren,Rui Song Nanoscale, 2020,12, 7024-7034
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Yaqing Liu,Jiangtao Ren,Jing Li,Jiyang Liu,Erkang Wang Chem. Commun., 2012,48, 802-804
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Hamid Heydari,Mohammad B. Gholivand New J. Chem., 2017,41, 237-244
857640-31-4 (5-CHLORO-3-(3,4-DIMETHOXYPHENYL)-1-METHYL-1H-PYRAZOLE-4-METHANOL) Related Products
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