Cas no 22442-07-5 (Cyclooctanone,2-(phenylmethyl)-)
22442-07-5 structure
Product Name:Cyclooctanone,2-(phenylmethyl)-
CAS No:22442-07-5
MF:C15H20O
MW:216.318704605103
CID:276187
PubChem ID:3047755
Update Time:2025-04-19
Cyclooctanone,2-(phenylmethyl)- Chemical and Physical Properties
Names and Identifiers
-
- Cyclooctanone,2-(phenylmethyl)-
- 2-benzylcyclooctan-1-one
- 2-Benzylcyclooctanone
- SCHEMBL7338783
- XVPYEGUVJMPSJN-UHFFFAOYSA-N
- 22442-07-5
- Cyclooctanone, 2-(phenylmethyl)-
- DTXSID00945129
-
- Inchi： 1S/C15H20O/c16-15-11-7-2-1-6-10-14(15)12-13-8-4-3-5-9-13/h3-5,8-9,14H,1-2,6-7,10-12H2
- InChI Key： XVPYEGUVJMPSJN-UHFFFAOYSA-N
- SMILES： O=C1CCCCCCC1CC1C=CC=CC=1
Computed Properties
- Exact Mass: 216.1515
- Monoisotopic Mass: 216.151415
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 16
- Rotatable Bond Count: 2
- Complexity: 216
- 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: 17.1
- XLogP3: 4
Experimental Properties
- Density: 0.998
- Boiling Point: 338.3°C at 760 mmHg
- Flash Point: 144°C
- Refractive Index: 1.522
- PSA: 17.07
Cyclooctanone,2-(phenylmethyl)- Related Literature
-
Cheng Fang,Jinjian Wu,Zahra Sobhani,Md. Al Amin,Youhong Tang Anal. Methods, 2019,11, 163-170
-
M. T. Colomer,S. Díaz-Moreno,A. Tamayo,A. L. Ortiz J. Mater. Chem. C, 2018,6, 12643-12651
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P. K. Wawrzyniak,M. T. P. Beerepoot,H. J. M. de Groot,F. Buda Phys. Chem. Chem. Phys., 2011,13, 10270-10279
22442-07-5 (Cyclooctanone,2-(phenylmethyl)-) Related Products
- 5910-25-8(3-Phenyl-2,4-pentanedione)
- 946-33-8(2-Benzylcyclohexan-1-one)
- 3506-88-5(3-Benzyl-4-phenylbutan-2-one)
- 1444-65-1(2-phenylcyclohexan-1-one)
- 2550-27-8(3-Methyl-4-phenylbutan-2-one)
- 1134-87-8(3-Benzyl-2,4-pentanedione)
- 38861-78-8(4-Isobutylacetophenone)
- 40463-09-0(4-Methyl-1-phenylpentan-3-one)
- 2893-05-2(1-Phenyl-3-methyl-2-butanone)
- 5349-62-2(4-Methyl-1-phenyl-2-pentanone)
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