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CAS Number: 29648-66-6
4-methylenecyclohexanone

Structure

 4-methylenecyclohexanone
Name: 4-methylenecyclohexanone
Synonyms:
General Information
Product Number: 29648666
CAS Registry Number: 29648-66-6
Name:
        Cyclohexanone, 4-​methylene-
        4-​Methylenecyclohexano​ne 
 
Chemical Formula: C7H10O
Exact Mass: 110.07
Molecular Weight: 110.15
m/z: 110.07 (100.0%), 111.08 (7.7%)
Elemental Analysis: C, 76.33; H, 9.15; O, 14.52
 
InChI: InChI=1S/C7H10O/c1-6-2-4-7(8)5-3-6/h1-5H2
InChIKey: SDJWUMGNEHCWOH-UHFFFAOYSA-N
Canonical SMILES : C=C1CCC(=O)CC1
 
Thermal Properties Value Condition Note
Boiling Point 70-80 °C Press: 15 Torr (1)IC
Boiling Point See full text   (2)CAS

Specification

98%
References
  1. (1) Coughlin, Daniel J.; Journal of Organic Chemistry 1979, V44(22), P3784-90 CAPLUS
  2. (2) Dolbier, William R., Jr.; Collection of Czechoslovak Chemical Communications 2002, V67(10), P1517-1532 CAPLUS
  3. (3) WSS: Spectral data were obtained from Wiley Subscription Services, Inc. (US)
  4. (4) Kabalka, George W.; Applied Organometallic Chemistry 2008, V22(9), P516-522 CAPLUS
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