Cas no 126794-87-4 (Ethanimidoyl chloride,N-(1-oxopropoxy)-)
126794-87-4 structure
Product Name:Ethanimidoyl chloride,N-(1-oxopropoxy)-
CAS No:126794-87-4
MF:C5H8ClNO2
MW:149.575520515442
CID:152065
PubChem ID:9589285
Update Time:2025-04-19
Ethanimidoyl chloride,N-(1-oxopropoxy)- Chemical and Physical Properties
Names and Identifiers
-
- Ethanimidoyl chloride,N-(1-oxopropoxy)-
- [(Z)-1-chloroethylideneamino] propanoate
- BRN 4243100
- Ethanimidoyl chloride, N-(1-oxopropoxy)-
- N-(1-Oxopropoxy)ethanimidoyl chloride
- 126794-87-4
-
- Inchi: 1S/C5H8ClNO2/c1-3-5(8)9-7-4(2)6/h3H2,1-2H3/b7-4-
- InChI Key: RCDPCDAROHGKOA-DAXSKMNVSA-N
- SMILES: Cl/C(/C)=N\OC(CC)=O
Computed Properties
- Exact Mass: 149.02444
- Monoisotopic Mass: 149.0243562g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 9
- Rotatable Bond Count: 3
- Complexity: 133
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 1
- Undefined Bond Stereocenter Count: 0
- XLogP3: 1.6
- Topological Polar Surface Area: 38.7?2
Experimental Properties
- PSA: 38.66
Ethanimidoyl chloride,N-(1-oxopropoxy)- Related Literature
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Sowmyalakshmi Venkataraman RSC Adv., 2015,5, 73807-73813
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Olga Guselnikova,Gérard Audran,Jean-Patrick Joly,Andrii Trelin,Evgeny V. Tretyakov,Vaclav Svorcik,Oleksiy Lyutakov,Sylvain R. A. Marque Chem. Sci., 2021,12, 4154-4161
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Maomao Hou,Fenglin Zhong,Qiu Jin,Enjiang Liu,Jie Feng,Tengyun Wang,Yue Gao RSC Adv., 2017,7, 34392-34400
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J. Xu,T. J. Carrocci,A. A. Hoskins Chem. Commun., 2016,52, 549-552
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Jason Wan Lab Chip, 2020,20, 4528-4538
126794-87-4 (Ethanimidoyl chloride,N-(1-oxopropoxy)-) Related Products
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