Cas no 302542-49-0 (1H-Pyrazole-1-acetamide,N-(3-methylphenyl)-)
302542-49-0 structure
Product Name:1H-Pyrazole-1-acetamide,N-(3-methylphenyl)-
CAS No:302542-49-0
MF:C12H13N3O
MW:215.251122236252
CID:303742
Update Time:2024-01-28
1H-Pyrazole-1-acetamide,N-(3-methylphenyl)- Chemical and Physical Properties
Names and Identifiers
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- 1H-Pyrazole-1-acetamide,N-(3-methylphenyl)-
- 1H-Pyrazole-1-acetamide, N-(3-methylphenyl)-
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- Inchi： 1S/C12H13N3O/c1-10-4-2-5-11(8-10)14-12(16)9-15-7-3-6-13-15/h2-8H,9H2,1H3,(H,14,16)
- InChI Key： BZQITJCMVYVNJD-UHFFFAOYSA-N
- SMILES： N1(CC(NC2=CC=CC(C)=C2)=O)C=CC=N1
Computed Properties
- Exact Mass: 215.10599
Experimental Properties
- Density: 1.16±0.1 g/cm3(Predicted)
- Boiling Point: 427.9±28.0 °C(Predicted)
- PSA: 46.92
- pka: 13.56±0.70(Predicted)
1H-Pyrazole-1-acetamide,N-(3-methylphenyl)- Related Literature
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Jason Y. C. Lim,Yong Yu,Guorui Jin,Kai Li,Yi Lu,Jianping Xie Nanoscale Adv., 2020,2, 3921-3932
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Shintaro Takata,Yoshihiro Miura Phys. Chem. Chem. Phys., 2014,16, 24784-24789
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Fereshteh Bayat Environ. Sci.: Nano, 2021,8, 367-389
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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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Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
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