Cas no 58024-22-9 (Aceticacid, 2-(nitrosothio)-)
Aceticacid, 2-(nitrosothio)- structure
Product Name:Aceticacid, 2-(nitrosothio)-
CAS No:58024-22-9
MF:C2H3NO3S
MW:121.115119218826
CID:386331
PubChem ID:187921
Update Time:2025-04-19
Aceticacid, 2-(nitrosothio)- Chemical and Physical Properties
Names and Identifiers
-
- Aceticacid, 2-(nitrosothio)-
- 2-Nitrososulfanylacetic acid
- DTXSID00206747
- 58024-22-9
- AKOS006379765
- SCHEMBL12813437
- S-nitrosomercaptoacetic acid
-
- Inchi: 1S/C2H3NO3S/c4-2(5)1-7-3-6/h1H2,(H,4,5)
- InChI Key: GWLFFJKFPZWJKP-UHFFFAOYSA-N
- SMILES: S(CC(=O)O)N=O
Computed Properties
- Exact Mass: 120.98339
- Monoisotopic Mass: 120.983
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 7
- Rotatable Bond Count: 2
- Complexity: 83
- 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: -0.2
- Topological Polar Surface Area: 92?2
Experimental Properties
- Density: 1.6
- Boiling Point: 276.3°Cat760mmHg
- Flash Point: 120.9°C
- Refractive Index: 1.583
- PSA: 66.73
Aceticacid, 2-(nitrosothio)- Related Literature
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Tanya Ostapenko,Peter J. Collings,Samuel N. Sprunt,J. T. Gleeson Soft Matter, 2013,9, 9487-9498
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Huiying Xu,Lu Zheng,Yu Zhou,Bang-Ce Ye Analyst, 2021,146, 5542-5549
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Chandran Rajendran,Govindaswamy Satishkumar,Charlotte Lang,Eric M. Gaigneaux Catal. Sci. Technol., 2020,10, 2583-2592
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