Cas no 110100-03-3 (2(1H)-Pyrimidinone, 5-(1-oxopentyl)-)
110100-03-3 structure
Product Name:2(1H)-Pyrimidinone, 5-(1-oxopentyl)-
CAS No:110100-03-3
MF:C9H12N2O2
MW:180.203782081604
CID:1191023
Update Time:2024-08-05
2(1H)-Pyrimidinone, 5-(1-oxopentyl)- Chemical and Physical Properties
Names and Identifiers
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- 2(1H)-Pyrimidinone, 5-(1-oxopentyl)-
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- Inchi： 1S/C9H12N2O2/c1-2-3-4-8(12)7-5-10-9(13)11-6-7/h5-6H,2-4H2,1H3,(H,10,11,13)
- InChI Key： CDYDPLMQBSVZFS-UHFFFAOYSA-N
- SMILES： C1(=O)NC=C(C(=O)CCCC)C=N1
Computed Properties
- Exact Mass: 180.08996
Experimental Properties
- Density: 1.18±0.1 g/cm3(Predicted)
- PSA: 58.53
- pka: 8.13±0.10(Predicted)
2(1H)-Pyrimidinone, 5-(1-oxopentyl)- Related Literature
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Cheng Fang,Jinjian Wu,Zahra Sobhani,Md. Al Amin,Youhong Tang Anal. Methods, 2019,11, 163-170
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Teresita Carrillo-Hernández,Philippe Schaeffer,Pierre Albrecht Chem. Commun., 2001, 1976-1977
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Somenath Panda,Kaushik Kundu,Anusha Basaiahgari,Sanjib Senapati,Ramesh L. Gardas New J. Chem., 2018,42, 7105-7118
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M. T. Colomer,S. Díaz-Moreno,A. Tamayo,A. L. Ortiz J. Mater. Chem. C, 2018,6, 12643-12651
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Bidyut Kumar Kundu,Rinky Singh,Ritudhwaj Tiwari,Debasis Nayak New J. Chem., 2019,43, 4867-4877
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