Cas no 30188-95-5 (4(3H)-Pyrimidinone,2,6-diamino-5-[2-(3-methoxyphenyl)diazenyl]-)
![4(3H)-Pyrimidinone,2,6-diamino-5-[2-(3-methoxyphenyl)diazenyl]- structure](https://ossimg.kuujia.com/scimg/30500/30188-95-5x500.png)
30188-95-5 structure
Product Name:4(3H)-Pyrimidinone,2,6-diamino-5-[2-(3-methoxyphenyl)diazenyl]-
CAS No:30188-95-5
MF:C11H12N6O2
MW:260.251980781555
CID:320261
PubChem ID:135399066
Update Time:2025-04-19
4(3H)-Pyrimidinone,2,6-diamino-5-[2-(3-methoxyphenyl)diazenyl]- Chemical and Physical Properties
Names and Identifiers
-
- 4(3H)-Pyrimidinone,2,6-diamino-5-[2-(3-methoxyphenyl)diazenyl]-
- (5E)-2,6-diamino-5-[(3-methoxyphenyl)hydrazinylidene]pyrimidin-4-one
- 2,6-diamino-pyrimidin-4,5-dione 5-[(3-methoxy-phenyl)-hydrazone]
- NSC114434
- DTXSID40421639
- NSC-114434
- 30188-95-5
-
- Inchi： 1S/C11H12N6O2/c1-19-7-4-2-3-6(5-7)16-17-8-9(12)14-11(13)15-10(8)18/h2-5H,1H3,(H5,12,13,14,15,18)/b17-16+
- InChI Key： QCLDBZRPKKBVQV-WUKNDPDISA-N
- SMILES： O(C)C1C=CC=C(C=1)/N=N/C1C(NC(N)=NC=1N)=O
Computed Properties
- Exact Mass: 260.10236
- Monoisotopic Mass: 260.102
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 3
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 19
- Rotatable Bond Count: 3
- Complexity: 456
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 1
- Topological Polar Surface Area: 127A^2
- XLogP3: 0.2
Experimental Properties
- Density: 1.54
- Boiling Point: 458°C at 760 mmHg
- Flash Point: 230.8°C
- Refractive Index: 1.718
- PSA: 127.45
- LogP: 2.52070
4(3H)-Pyrimidinone,2,6-diamino-5-[2-(3-methoxyphenyl)diazenyl]- Related Literature
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Thi Thu Tram Nguyen,Thanh Binh Nguyen Org. Biomol. Chem., 2021,19, 6015-6020
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Joseph W. Bennett,Diamond T. Jones,Blake G. Hudson,Joshua Melendez-Rivera,Robert J. Hamers,Sara E. Mason Environ. Sci.: Nano, 2020,7, 1642-1651
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M. Zeiger,N. J?ckel,P. Strubel,L. Borchardt,R. Reinhold,W. Nickel,J. Eckert,V. Presser,S. Kaskel J. Mater. Chem. A, 2015,3, 17983-17990
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Sowmyalakshmi Venkataraman RSC Adv., 2015,5, 73807-73813
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Amandine Altmayer-Henzien,Valérie Declerck,David J. Aitken,Ewen Lescop,Denis Merlet,Jonathan Farjon Org. Biomol. Chem., 2013,11, 7611-7615
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