Cas no 58896-59-6 (Methanaminium, N-(chlorophenylmethylene)-N-methyl-)
58896-59-6 structure
Product Name:Methanaminium, N-(chlorophenylmethylene)-N-methyl-
CAS No:58896-59-6
MF:C9H11ClN
MW:168.643341302872
CID:340497
PubChem ID:10954663
Update Time:2025-04-19
Methanaminium, N-(chlorophenylmethylene)-N-methyl- Chemical and Physical Properties
Names and Identifiers
-
- Methanaminium, N-(chlorophenylmethylene)-N-methyl-
- [chloro(phenyl)methylidene]-dimethylazanium
- 58896-59-6
- DTXSID40449651
- SCHEMBL8089938
-
- Inchi： 1S/C9H11ClN/c1-11(2)9(10)8-6-4-3-5-7-8/h3-7H,1-2H3/q+1
- InChI Key： UFDSTKYRXJIBRY-UHFFFAOYSA-N
- SMILES： Cl/C(/C1C=CC=CC=1)=[N+](/C)\C
Computed Properties
- Exact Mass: 168.05813
- Monoisotopic Mass: 168.0580020g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 0
- Heavy Atom Count: 11
- Rotatable Bond Count: 1
- Complexity: 153
- 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: 2.5
- Topological Polar Surface Area: 3?2
Experimental Properties
- PSA: 3.01
Methanaminium, N-(chlorophenylmethylene)-N-methyl- Related Literature
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Inês S. Albuquerque,Hélia F. Jeremias,Miguel Chaves-Ferreira,Dijana Matak-Vinkovic,Omar Boutureira,Carlos C. Rom?o Chem. Commun., 2015,51, 3993-3996
-
Xin Li,Liangliang Zhu,Sai Duan,Yanli Zhao,Hans ?gren Phys. Chem. Chem. Phys., 2014,16, 23854-23860
-
Bidou Wang,Xifeng Chen Analyst, 2014,139, 5695-5699
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