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Also known as: 5500-21-0, Cyclopropyl cyanide, Cyanocyclopropane, Cyclopropylnitrile, Cyclopropanenitrile, 1-cyanocyclopropane
Molecular Formula
C4H5N
Molecular Weight
67.09  g/mol
InChI Key
AUQDITHEDVOTCU-UHFFFAOYSA-N

CAS 5500-21-0
1 2D Structure

CAS 5500-21-0

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
cyclopropanecarbonitrile
2.1.2 InChI
InChI=1S/C4H5N/c5-3-4-1-2-4/h4H,1-2H2
2.1.3 InChI Key
AUQDITHEDVOTCU-UHFFFAOYSA-N
2.1.4 Canonical SMILES
C1CC1C#N
2.2 Synonyms
2.2.1 Depositor-Supplied Synonyms

1. 5500-21-0

2. Cyclopropyl Cyanide

3. Cyanocyclopropane

4. Cyclopropylnitrile

5. Cyclopropanenitrile

6. 1-cyanocyclopropane

7. Cyclopropane Carbonitrile

8. Mfcd00001269

9. Cyclopropane Cyanide

10. Cyclopropancarbonitril

11. Cyclopropylcyanide

12. Einecs 226-836-8

13. Nsc 60191

14. Cyclopropankohlenitrile

15. Ai3-07023

16. Unii-afu99gzs5d

17. Afu99gzs5d

18. Cyclopropanecarbonitrile, 98%

19. Dtxsid1063936

20. Amy3403

21. Cyclopropanecarboxylic Acid Nitrile

22. Act03326

23. Cs-d1406

24. Nsc60191

25. Zinc1690063

26. Nsc-60191

27. Stk328117

28. Akos000121165

29. Bp-10177

30. Db-007375

31. Ft-0602346

32. A830440

33. Q5198968

34. F0001-1444

35. Z1245735215

2.3 Create Date
2005-03-26
3 Chemical and Physical Properties
Molecular Weight 67.09 g/mol
Molecular Formula C4H5N
XLogP30.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count0
Exact Mass67.042199164 g/mol
Monoisotopic Mass67.042199164 g/mol
Topological Polar Surface Area23.8 Ų
Heavy Atom Count5
Formal Charge0
Complexity72.9
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1

BUILDING BLOCK

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SUPPLIERS

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01

STLE Annual Meeting
Not Confirmed
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STLE Annual Meeting
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Cyclopropane Carbonitrile

CAS Number : 5500-21-0

End Use API :

About the Company : Shree Ganesh Remedies is established Since 1995 with an aim to manufacture, supply and export best quality of Pharmaceutical-intermediates, Bulk drugs and Speciality Chemicals to cater ...

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02

STLE Annual Meeting
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STLE Annual Meeting
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Diethyl 1,1-cyclopropanedicarboxylate

CAS Number : 1559-02-0

End Use API :

About the Company : Shree Ganesh Remedies is established Since 1995 with an aim to manufacture, supply and export best quality of Pharmaceutical-intermediates, Bulk drugs and Speciality Chemicals to cater ...

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