Cas no 7465-40-9 (1,2,3-Oxadiazolium,5-hydroxy-3-[2-(4-methylphenyl)ethyl]-, inner salt)
![1,2,3-Oxadiazolium,5-hydroxy-3-[2-(4-methylphenyl)ethyl]-, inner salt structure](https://ossimg.kuujia.com/scimg/7500/7465-40-9x500.png)
7465-40-9 structure
Product Name:1,2,3-Oxadiazolium,5-hydroxy-3-[2-(4-methylphenyl)ethyl]-, inner salt
CAS No:7465-40-9
MF:C11H12N2O2
MW:204.225182533264
CID:581393
PubChem ID:24188145
Update Time:2025-04-19
1,2,3-Oxadiazolium,5-hydroxy-3-[2-(4-methylphenyl)ethyl]-, inner salt Chemical and Physical Properties
Names and Identifiers
-
- 1,2,3-Oxadiazolium,5-hydroxy-3-[2-(4-methylphenyl)ethyl]-, inner salt
- 3-[2-(4-methylphenyl)ethyl]oxadiazol-3-ium-5-olate
- 7465-40-9
- 3-[2-(4-Methylphenyl)ethyl]-1,2,3-oxadiazol-3-ium-5-olate
- DTXSID90637460
- NSC-72460
- NSC72460
-
- Inchi： 1S/C11H12N2O2/c1-9-2-4-10(5-3-9)6-7-13-8-11(14)15-12-13/h2-5,8H,6-7H2,1H3
- InChI Key： OIZVDHNQORSOPP-UHFFFAOYSA-N
- SMILES： O1C(=C[N+](CCC2C=CC(C)=CC=2)=N1)[O-]
Computed Properties
- Exact Mass: 204.089877630g/mol
- Monoisotopic Mass: 204.089877630g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 15
- Rotatable Bond Count: 3
- Complexity: 193
- 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: 3.4
- Topological Polar Surface Area: 53?2
Experimental Properties
- Boiling Point: °Cat760mmHg
- Flash Point: °C
1,2,3-Oxadiazolium,5-hydroxy-3-[2-(4-methylphenyl)ethyl]-, inner salt Related Literature
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Fereshteh Bayat Environ. Sci.: Nano, 2021,8, 367-389
-
Ji-Ping Wei Nanoscale, 2015,7, 11815-11832
-
Hongxia Li,Aikifa Raza,Qiaoyu Ge,Jin-You Lu,TieJun Zhang Soft Matter, 2020,16, 6841-6849
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