Cas no 70074-11-2 (4-Pyrimidinamine,N-(4-butylphenyl)-2-(3,5-dimethyl-1H-pyrazol-1-yl)-6-methyl-)
70074-11-2 structure
Product Name:4-Pyrimidinamine,N-(4-butylphenyl)-2-(3,5-dimethyl-1H-pyrazol-1-yl)-6-methyl-
CAS No:70074-11-2
MF:C20H25N5
MW:335.446003675461
CID:547760
Update Time:2024-03-06
4-Pyrimidinamine,N-(4-butylphenyl)-2-(3,5-dimethyl-1H-pyrazol-1-yl)-6-methyl- Chemical and Physical Properties
Names and Identifiers
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- 4-Pyrimidinamine,N-(4-butylphenyl)-2-(3,5-dimethyl-1H-pyrazol-1-yl)-6-methyl-
- N-(4-butylphenyl)-2-(3,5-dimethyl-1H-pyrazol-1-yl)-6-methylpyrimidin-4-amine
- 4-Pyrimidinamine, N-(4-butylphenyl)-2-(3,5-dimethyl-1H-pyrazol-1-yl)-6-methyl-
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- Inchi: 1S/C20H25N5/c1-5-6-7-17-8-10-18(11-9-17)22-19-13-14(2)21-20(23-19)25-16(4)12-15(3)24-25/h8-13H,5-7H2,1-4H3,(H,21,22,23)
- InChI Key: KDGHVMIYHIGTQT-UHFFFAOYSA-N
- SMILES: C1(N2C(C)=CC(C)=N2)=NC(C)=CC(NC2=CC=C(CCCC)C=C2)=N1
Computed Properties
- Exact Mass: 335.21125
Experimental Properties
- Density: 1.13±0.1 g/cm3(Predicted)
- Boiling Point: 544.7±52.0 °C(Predicted)
- PSA: 55.63
- pka: 4.03±0.10(Predicted)
4-Pyrimidinamine,N-(4-butylphenyl)-2-(3,5-dimethyl-1H-pyrazol-1-yl)-6-methyl- Related Literature
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Teresita Carrillo-Hernández,Philippe Schaeffer,Pierre Albrecht Chem. Commun., 2001, 1976-1977
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Bidyut Kumar Kundu,Rinky Singh,Ritudhwaj Tiwari,Debasis Nayak New J. Chem., 2019,43, 4867-4877
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Alvin Tanudjaja,Shinsuke Inagi,Fusao Kitamura,Toshikazu Takata,Ikuyoshi Tomita Dalton Trans., 2021,50, 3037-3043
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Siquan Zhang,Shengyao Wang,Liping Guo,Hao Chen,Bien Tan,Shangbin Jin J. Mater. Chem. C, 2020,8, 192-200
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Stephen P. Fletcher,Richard B. C. Jagt,Ben L. Feringa Chem. Commun., 2007, 2578-2580
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