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2D Structure
Also known as: 42252-34-6, Ethylmethyl-carbamic chloride, Ethyl(methyl)carbamic chloride, N-ethyl-n-methylcarbamoylchloride, Ethylmethyl-carbamicchloride, N-ethyl-n-methyl carbamoyl chloride
Molecular Formula
C4H8ClNO
Molecular Weight
121.56  g/mol
InChI Key
XZVYDRLPXWFRIS-UHFFFAOYSA-N

1 2D Structure

2D Structure

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
N-ethyl-N-methylcarbamoyl chloride
2.1.2 InChI
InChI=1S/C4H8ClNO/c1-3-6(2)4(5)7/h3H2,1-2H3
2.1.3 InChI Key
XZVYDRLPXWFRIS-UHFFFAOYSA-N
2.1.4 Canonical SMILES
CCN(C)C(=O)Cl
2.2 Synonyms
2.2.1 Depositor-Supplied Synonyms

1. 42252-34-6

2. Ethylmethyl-carbamic Chloride

3. Ethyl(methyl)carbamic Chloride

4. N-ethyl-n-methylcarbamoylchloride

5. Ethylmethyl-carbamicchloride

6. N-ethyl-n-methyl Carbamoyl Chloride

7. N-ethyl-n-methyl Carbamoylchloride

8. N-ethyl-n-methylcarbamonyl Chloride

9. N-ethyl-n-methyl-carbamoyl Chloride

10. Carbamic Chloride, Ethylmethyl-

11. Ethylmethylcarbamic Chloride

12. Ethyl Methylcarbamic Chloride

13. Ethylmethyl Carbamyl Chloride

14. Schembl414542

15. Ethyl(methyl)carbamoyl Chloride

16. Dtxsid60459696

17. Act08763

18. Bcp27350

19. Mfcd08061404

20. Zinc21992762

21. Akos006285962

22. Mb05193

23. N-ethyl-n-methylcarbamoyl Chloride+b31

24. As-12359

25. Db-013277

26. Am20090787

27. Carbamic Chloride, N-ethyl-n-methyl-

28. Cs-0198150

29. E0963

30. Ft-0649367

31. F20387

32. 252e346

33. Q-101326

2.3 Create Date
2006-10-26
3 Chemical and Physical Properties
Molecular Weight 121.56 g/mol
Molecular Formula C4H8ClNO
XLogP31.2
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count1
Exact Mass121.0294416 g/mol
Monoisotopic Mass121.0294416 g/mol
Topological Polar Surface Area20.3 Ų
Heavy Atom Count7
Formal Charge0
Complexity74.1
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1