Cas no 70498-12-3 ((Chloromethyl)prop-2-en-1-ylcarbamyl chloride)
70498-12-3 structure
Product Name:(Chloromethyl)prop-2-en-1-ylcarbamyl chloride
CAS No:70498-12-3
MF:C5H7Cl2NO
MW:168.021179437637
CID:2799656
PubChem ID:55301889
Update Time:2025-04-21
(Chloromethyl)prop-2-en-1-ylcarbamyl chloride Chemical and Physical Properties
Names and Identifiers
-
- AKOS006383779
- DTXSID60717708
- (Chloromethyl)prop-2-en-1-ylcarbamyl chloride
- 70498-12-3
-
- Inchi： 1S/C5H7Cl2NO/c1-2-3-8(4-6)5(7)9/h2H,1,3-4H2
- InChI Key： GLLALTCVCOHQNN-UHFFFAOYSA-N
- SMILES： ClCN(C(=O)Cl)CC=C
Computed Properties
- Exact Mass: 166.9904692Da
- Monoisotopic Mass: 166.9904692Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 9
- Rotatable Bond Count: 3
- Complexity: 116
- 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: 2.1
- Topological Polar Surface Area: 20.3?2
(Chloromethyl)prop-2-en-1-ylcarbamyl chloride Related Literature
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Guiying Zhang,Maosheng Cheng,Yanni Li,Keliang Liu,Lifeng Cai Chem. Commun., 2013,49, 11086-11088
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Eric Besson,Stéphane Gastaldi,Emily Bloch,Selma Aslan,Hakim Karoui,Olivier Ouari,Micael Hardy Analyst, 2019,144, 4194-4203
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Aloke Das,K. K. Mahato,Chayan K. Nandi,Tapas Chakraborty,Shridhar R. Gadre,Nikhil A. Gokhale Phys. Chem. Chem. Phys., 2002,4, 2162-2168
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