Cas no 7027-11-4 (Cyclohexanecarbonitrile,1,3,3-trimethyl-5-oxo-)
7027-11-4 structure
Product Name:Cyclohexanecarbonitrile,1,3,3-trimethyl-5-oxo-
Cyclohexanecarbonitrile,1,3,3-trimethyl-5-oxo- Chemical and Physical Properties
Names and Identifiers
-
- Cyclohexanecarbonitrile,1,3,3-trimethyl-5-oxo-
- 1,3,3-Trimethyl-5-oxocyclohexanecarbonitrile
- 1,3,3-trimethyl-5-oxo-cyclohexane carbonitrile
- 1,3,3-trimethyl-5-oxo-cyclohexane-carbonitrile
- 3,3,5-Trimethyl-5-cyanocyclohexanone
- 3-Cyano-3,5,5-trimethylcyclohexanone
- 5-Oxo-1,3,3-trimethylcyc
- AI3-37061
- cyano-3 trimethyl-3,5,5 cyclohexanone
- Cychohexanecarbonitrile, 1,3,3-trimethyl-5-oxo-
- isophoronenitrile
- SBB056201
- NS00006843
- EC 411-490-4
- J23.556C
- Cyclohexanecarbonitrile, 5-oxo-1,3,3-trimethyl-
- 0IBM7D6DSA
- DTXSID8029284
- 1,3,3-trimethyl-5-oxo-1-cyclohexanecarbonitrile
- A840570
- 1,3,3-trimethyl-5-oxidanylidene-cyclohexane-1-carbonitrile
- isophorone nitrile
- EN300-7814060
- Q27236819
- CS-0261322
- Cyclohexanecarbonitrile, 1,3,3-trimethyl-5-oxo-
- UNII-0IBM7D6DSA
- NSC-171143
- NSC171143
- JJDFVIDVSCYKDS-UHFFFAOYSA-N
- AKOS006277145
- SCHEMBL647137
- 1,3,3-trimethyl-5-oxocyclohexane-1-carbonitrile
- 5-Oxo-1,3,3-trimethylcyclohexanecarbonitrile
- NSC 171143
- 5-oxo-1,3,3-trimethyl-cyclohexanecarbonitril
- 7027-11-4
- 3-cyano-3,5,5-trimethyl cyclohexanone
- 1,3,3-trimethyl-5-oxo-cyclohexanecarbonitrile
-
- MDL： MFCD01937789
- Inchi： 1S/C10H15NO/c1-9(2)4-8(12)5-10(3,6-9)7-11/h4-6H2,1-3H3
- InChI Key： JJDFVIDVSCYKDS-UHFFFAOYSA-N
- SMILES： O=C1CC(C#N)(C)CC(C)(C)C1
Computed Properties
- Exact Mass: 165.11545
- Monoisotopic Mass: 165.115364
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 12
- Rotatable Bond Count: 0
- Complexity: 258
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 40.9
- XLogP3: 1.3
Experimental Properties
- Density: 1.53
- Boiling Point: 677.2°C at 760 mmHg
- Flash Point: 363.3°C
- Refractive Index: 1.701
- Stability/Shelf Life: Incompatible with strong oxidizing agents.
- PSA: 40.86
Cyclohexanecarbonitrile,1,3,3-trimethyl-5-oxo- Security Information
- Hazard Category Code： 22-43-48/22-52/53
- Safety Instruction： 36/37-61
-
Hazardous Material Identification：
- Risk Phrases：22-43-48/22-52/53
Cyclohexanecarbonitrile,1,3,3-trimethyl-5-oxo- Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| Apollo Scientific | OR54837-1g |
1,3,3-Trimethyl-5-oxo-cyclohexane-1-carbonitrile |
7027-11-4 | 1g |
￡180.00 | 2025-02-20 | ||
| Apollo Scientific | OR54837-5g |
1,3,3-Trimethyl-5-oxo-cyclohexane-1-carbonitrile |
7027-11-4 | 5g |
￡718.00 | 2025-02-20 | ||
| Enamine | EN300-7814060-0.05g |
1,3,3-trimethyl-5-oxocyclohexane-1-carbonitrile |
7027-11-4 | 95.0% | 0.05g |
$451.0 | 2025-03-21 | |
| Enamine | EN300-7814060-0.1g |
1,3,3-trimethyl-5-oxocyclohexane-1-carbonitrile |
7027-11-4 | 95.0% | 0.1g |
$590.0 | 2025-03-21 | |
| Enamine | EN300-7814060-0.25g |
1,3,3-trimethyl-5-oxocyclohexane-1-carbonitrile |
7027-11-4 | 95.0% | 0.25g |
$842.0 | 2025-03-21 | |
| Enamine | EN300-7814060-0.5g |
1,3,3-trimethyl-5-oxocyclohexane-1-carbonitrile |
7027-11-4 | 95.0% | 0.5g |
$1326.0 | 2025-03-21 | |
| Enamine | EN300-7814060-1.0g |
1,3,3-trimethyl-5-oxocyclohexane-1-carbonitrile |
7027-11-4 | 95.0% | 1.0g |
$1701.0 | 2025-03-21 | |
| Enamine | EN300-7814060-2.5g |
1,3,3-trimethyl-5-oxocyclohexane-1-carbonitrile |
7027-11-4 | 95.0% | 2.5g |
$3332.0 | 2025-03-21 | |
| Enamine | EN300-7814060-5.0g |
1,3,3-trimethyl-5-oxocyclohexane-1-carbonitrile |
7027-11-4 | 95.0% | 5.0g |
$4930.0 | 2025-03-21 | |
| Enamine | EN300-7814060-10.0g |
1,3,3-trimethyl-5-oxocyclohexane-1-carbonitrile |
7027-11-4 | 95.0% | 10.0g |
$7312.0 | 2025-03-21 |
Cyclohexanecarbonitrile,1,3,3-trimethyl-5-oxo- Related Literature
-
Christopher B. Rodell,Christopher B. Highley,Minna H. Chen,Neville N. Dusaj,Chao Wang,Lin Han,Jason A. Burdick Soft Matter, 2016,12, 7839-7847
-
Eléonore Resongles,Corinne Casiot,Fran?oise Elbaz-Poulichet,Rémi Freydier,Odile Bruneel,Christine Piot,Sophie Delpoux,Aurélie Volant,Angélique Desoeuvre Environ. Sci.: Processes Impacts, 2013,15, 1536-1544
-
Sowmyalakshmi Venkataraman RSC Adv., 2015,5, 73807-73813
-
Ana G. Neo,Ana Bornadiego,Jesús Díaz,Stefano Marcaccini,Carlos F. Marcos Org. Biomol. Chem., 2013,11, 6546-6555
-
Eric Besson,Stéphane Gastaldi,Emily Bloch,Selma Aslan,Hakim Karoui,Olivier Ouari,Micael Hardy Analyst, 2019,144, 4194-4203
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