Cas no 29786-97-8 (1-Butanone,1-(2,4,6-trimethylphenyl)-)
29786-97-8 structure
Product Name:1-Butanone,1-(2,4,6-trimethylphenyl)-
CAS No:29786-97-8
MF:C13H18O
MW:190.281424045563
CID:286694
Update Time:2025-04-19
1-Butanone,1-(2,4,6-trimethylphenyl)- Chemical and Physical Properties
Names and Identifiers
-
- 1-Butanone,1-(2,4,6-trimethylphenyl)-
- 1-(2,4,6-trimethylphenyl)butan-1-one
- 1-Mesityl-butan-1-on
- 1-mesityl-butan-1-one
- 2,4,6-trimethylphenyl propyl ketone
- 2.4.6-Trimethyl-butyrophenon
- 21-Oxo-1.3.5-trimethyl-2-butyl-benzol
- AC1L5J7T
- AC1Q5D01
- AR-1B0107
- CTK4G3822
- KST-1B3436
- NSC71400
- Propyl-(2.4.6-trimethyl-phenyl)-keton
- SureCN7865769
-
- Inchi： 1S/C13H18O/c1-5-6-12(14)13-10(3)7-9(2)8-11(13)4/h7-8H,5-6H2,1-4H3
- InChI Key： FYUBXNBCVVKTBL-UHFFFAOYSA-N
- SMILES： O=C(CCC)C1C(C)=CC(C)=CC=1C
Computed Properties
- Exact Mass: 190.13584
- Monoisotopic Mass: 190.136
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 14
- Rotatable Bond Count: 3
- Complexity: 185
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
Experimental Properties
- Density: 0.938
- Boiling Point: 285.6°C at 760 mmHg
- Flash Point: 116.6°C
- Refractive Index: 1.503
- PSA: 17.07
- LogP: 3.59460
1-Butanone,1-(2,4,6-trimethylphenyl)- Related Literature
-
Yaling Zhang,Chunhui Dai,Shiwei Zhou,Bin Liu Chem. Commun., 2018,54, 10092-10095
-
Xinhuan Wang,Shuangfei Cai,Cui Qi Analyst, 2017,142, 2500-2506
-
Huading Zhang,Lee R. Moore,Maciej Zborowski,P. Stephen Williams,Shlomo Margel,Jeffrey J. Chalmers Analyst, 2005,130, 514-527
29786-97-8 (1-Butanone,1-(2,4,6-trimethylphenyl)-) Related Products
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