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Also known as: 152922-71-9, 2-(1-(hydroxymethyl)cyclopropyl)acetonitrile, 2-[1-(hydroxymethyl)cyclopropyl]acetonitrile, [1-(hydroxymethyl)cyclopropyl]acetonitrile, Cyclopropaneacetonitrile, 1-(hydroxymethyl)-, (1-hydroxymethyl-cyclopropyl)-acetonitrile
Molecular Formula
C6H9NO
Molecular Weight
111.14  g/mol
InChI Key
WYOMLUMUVAPMKE-UHFFFAOYSA-N

CAS 152922-71-9
1 2D Structure

CAS 152922-71-9

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
2-[1-(hydroxymethyl)cyclopropyl]acetonitrile
2.1.2 InChI
InChI=1S/C6H9NO/c7-4-3-6(5-8)1-2-6/h8H,1-3,5H2
2.1.3 InChI Key
WYOMLUMUVAPMKE-UHFFFAOYSA-N
2.1.4 Canonical SMILES
C1CC1(CC#N)CO
2.2 Synonyms
2.2.1 Depositor-Supplied Synonyms

1. 152922-71-9

2. 2-(1-(hydroxymethyl)cyclopropyl)acetonitrile

3. 2-[1-(hydroxymethyl)cyclopropyl]acetonitrile

4. [1-(hydroxymethyl)cyclopropyl]acetonitrile

5. Cyclopropaneacetonitrile, 1-(hydroxymethyl)-

6. (1-hydroxymethyl-cyclopropyl)-acetonitrile

7. Mfcd08235273

8. 1-(cyanomethyl)-1-(hydroxymethyl)cyclopropane

9. Schembl642970

10. Dtxsid90433348

11. Bcp12563

12. Zinc16125367

13. Akos013154494

14. Ac-1173

15. Am84486

16. Sb83927

17. (1-hydroxymethylcyclopropyl)acetonitrile

18. 1-(hydroxymethyl)cyclopropaneactetonitrile

19. Sy017671

20. Ts-01430

21. Cs-0044943

22. Ft-0659853

23. En300-92089

24. 2-[1-(hydroxymethyl)-cyclopropyl]-acetonitrile

25. I10037

26. 2-[1-(hydroxymethyl)cycloprop-1-yl]ethanonitrile

27. 922h719

28. J-503557

29. 1-(hydroxymethyl)cyclopropaneacetonitrile, Aldrichcpr

2.3 Create Date
2006-10-25
3 Chemical and Physical Properties
Molecular Weight 111.14 g/mol
Molecular Formula C6H9NO
XLogP3-0.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Exact Mass111.068413911 g/mol
Monoisotopic Mass111.068413911 g/mol
Topological Polar Surface Area44 Ų
Heavy Atom Count8
Formal Charge0
Complexity129
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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euroPLX 86 Munich
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euroPLX 86 Munich
Not Confirmed

1-(Hydroxy methyl)cyclopropane acetonitrile

CAS Number : 152922-71-9

End Use API :

About the Company : Nantong Chem-land Co., Ltd. is located in Nantong city, a developed port city which distance from Shanghai is only 1.5 hours by car. Established in 2006, we have developed quickly into ...

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