Cas no 6965-97-5 (2,4-Pyrimidinediamine,6-ethoxy-5-nitroso-)
6965-97-5 structure
Product Name:2,4-Pyrimidinediamine,6-ethoxy-5-nitroso-
CAS No:6965-97-5
MF:C6H9N5O2
MW:183.167959928513
CID:518698
PubChem ID:227250
Update Time:2025-04-19
2,4-Pyrimidinediamine,6-ethoxy-5-nitroso- Chemical and Physical Properties
Names and Identifiers
-
- 2,4-Pyrimidinediamine,6-ethoxy-5-nitroso-
- 6-ethoxy-5-nitrosopyrimidine-2,4-diamine
- 5-nitroso-2,6-diamino-4-ethoxy-pyrimidine
- 6-Aethoxy-5-nitroso-pyrimidin-2,4-diyldiamin
- 6-ethoxy-5-nitroso-pyrimidine-2,4-diyldiamine
- AC1L5FCU
- AC1Q6R23
- AG-K-74789
- AR-1H1612
- CTK5D0790
- NSC18699
- 6965-97-5
- SCHEMBL4454204
- VUTARFHXVDMWDZ-UHFFFAOYSA-N
- NSC-18699
- DTXSID30280792
-
- Inchi： 1S/C6H9N5O2/c1-2-13-5-3(11-12)4(7)9-6(8)10-5/h2H2,1H3,(H4,7,8,9,10)
- InChI Key： VUTARFHXVDMWDZ-UHFFFAOYSA-N
- SMILES： O(CC)C1C(=C(N)N=C(N)N=1)N=O
Computed Properties
- Exact Mass: 183.07577
- Monoisotopic Mass: 183.07562455g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 7
- Heavy Atom Count: 13
- Rotatable Bond Count: 2
- Complexity: 178
- 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
- XLogP3: 0.1
- Topological Polar Surface Area: 117?2
Experimental Properties
- PSA: 116.48
2,4-Pyrimidinediamine,6-ethoxy-5-nitroso- Related Literature
-
Kay S. McMillan,Anthony G. McCluskey,Annette Sorensen,Marie Boyd,Michele Zagnoni Analyst, 2016,141, 100-110
-
Manickam Bakthadoss,Tadiparthi Thirupathi Reddy,Vishal Agarwal,Duddu S. Sharada Chem. Commun., 2022,58, 1406-1409
-
Jing Yu,Yu-Qi Lyu,Jiapeng Liu,Mohammed B. Effat,Junxiong Wu J. Mater. Chem. A, 2019,7, 17995-18002
-
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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