CAS 6228-73-5

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CHEMISTRY

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Chemistry

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Also known as: 6228-73-5, Cyclopropylcarboxamide, Carbamoylcyclopropane, Cyclopropyl carboxamide, Cyclopropancarboxamide, 6628-73-5

Molecular Formula

C₄H₇NO

Molecular Weight

85.10 g/mol

InChI Key

AIMMVWOEOZMVMS-UHFFFAOYSA-N

FDA UNII

NA7A3S4MUT

1 2D Structure

CAS 6228-73-5

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

cyclopropanecarboxamide

2.1.2 InChI

InChI=1S/C4H7NO/c5-4(6)3-1-2-3/h3H,1-2H2,(H2,5,6)

2.1.3 InChI Key

AIMMVWOEOZMVMS-UHFFFAOYSA-N

2.1.4 Canonical SMILES

C1CC1C(=O)N

2.2 Other Identifiers

2.2.1 UNII

NA7A3S4MUT

2.3 Synonyms

2.3.1 Depositor-Supplied Synonyms

1. 6228-73-5

2. Cyclopropylcarboxamide

3. Carbamoylcyclopropane

4. Cyclopropyl Carboxamide

5. Cyclopropancarboxamide

6. 6628-73-5

7. Chebi:51457

8. Na7a3s4mut

9. Cyclopropanecarboxylic Acid Amide

10. Seed One

11. Mfcd00013729

12. Nsc-402033

13. Cyclopropanamide

14. Cyclopropancarboxamid

15. Einecs 228-332-3

16. Nsc402033

17. Nsc 402033

18. 1-cyclopropanecarboxamide

19. Ai3-62011

20. Unii-na7a3s4mut

21. Chembl274503

22. Dtxsid7064150

23. Zinc1594556

24. Bdbm50224831

25. Stk039769

26. Akos005207081

27. Cs-w011356

28. Sb40651

29. Ac-13088

30. As-17897

31. Sy018785

32. Db-007376

33. Am20100524

34. Ft-0624282

35. Ft-0648916

36. Ft-0665388

37. A15708

38. R10019

39. W-110090

40. Q27122613

2.4 Create Date

2005-03-26

3 Chemical and Physical Properties

Molecular Formula	C₄H₇NO
Molecular Weight	85.10 g/mol
XLogP3	-0.4
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	1
Exact Mass	85.052763847 g/mol
Monoisotopic Mass	85.052763847 g/mol
Topological Polar Surface Area	43.1 Å²
Heavy Atom Count	6
Formal Charge	0
Complexity	75.6
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently Bonded Unit Count	1