Cas no 61201-44-3 (nitroacetate)
nitroacetate structure
Product Name:nitroacetate
CAS No:61201-44-3
MF:C2H2NO4
MW:104.041580677032
CID:1625970
PubChem ID:43580
Update Time:2025-04-21
nitroacetate Chemical and Physical Properties
Names and Identifiers
-
- nitroacetate
- 2-nitroacetate
- 61201-44-3
- RGHXWDVNBYKJQH-UHFFFAOYSA-M
- DTXSID40210121
- SCHEMBL1389654
-
- Inchi： 1S/C2H3NO4/c4-2(5)1-3(6)7/h1H2,(H,4,5)/p-1
- InChI Key： RGHXWDVNBYKJQH-UHFFFAOYSA-M
- SMILES： [O-][N+](CC(=O)[O-])=O
Computed Properties
- Exact Mass: 103.99836
- Monoisotopic Mass: 103.99838255g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 7
- Rotatable Bond Count: 0
- Complexity: 86.8
- 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: 0.4
- Topological Polar Surface Area: 86?2
Experimental Properties
- PSA: 83.27
nitroacetate Related Literature
-
Weili Dai,Guangjun Wu,Michael Hunger Chem. Commun., 2015,51, 13779-13782
-
Tengfei Yu,Yuehan Wu,Wei Li,Bin Li RSC Adv., 2014,4, 34134-34143
-
Vishwesh Venkatraman,Marco Foscato,Vidar R. Jensen,Bj?rn K?re Alsberg J. Mater. Chem. A, 2015,3, 9851-9860
-
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
-
Albertus D. Handoko,Khoong Hong Khoo,Teck Leong Tan,Hongmei Jin,Zhi Wei Seh J. Mater. Chem. A, 2018,6, 21885-21890
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