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CAS Number: 1234616-26-2
3-(3,3-difluorocyclobutyl)-3-oxopropanenitrile

Structure

3-(3,3-difluorocyclobutyl)-3-oxopropanenitrile
Name: 3-(3,3-difluorocyclobutyl)-3-oxopropanenitrile
Synonyms:
General Information
Product Number: 1234616262

CAS Registry Number: 1234616-26-2

Name:

Cyclobutanepropaneni​trile, 3,​3-​difluoro-​β-​oxo-
3-​(3,​3-​Difluorocyclobutyl)​-​3-​oxopropanenitrile 

 

Chemical Formula: C7H7F2NO
Exact Mass: 159.05
Molecular Weight: 159.13
m/z: 159.05 (100.0%), 160.05 (8.0%)
Elemental Analysis: C, 52.83; H, 4.43; F, 23.88; N, 8.80; O, 10.05

 

InChI: InChI=1S/C7H7F2NO/c8-7(9)3-5(4-7)6(11)1-2-10/h5H,1,3-4H2
InChIKey: XZOQNSZPBYTVMA-UHFFFAOYSA-N
Canonical SMILES : C1C(CC1(F)F)C(=O)CC#N

Specification

98%

References

PCT Int. Appl. (2014), WO 2014029723 A1 20140227.                                 

PCT Int. Appl. (2013), WO 2013092940 A1 20130627. 

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