Cas no 81325-25-9 (1H-Imidazole, 1-(2,4,6-trimethylbenzoyl)-)
81325-25-9 structure
Product Name:1H-Imidazole, 1-(2,4,6-trimethylbenzoyl)-
CAS No:81325-25-9
MF:C13H14N2O
MW:214.263062953949
CID:704155
PubChem ID:12852198
Update Time:2025-04-19
1H-Imidazole, 1-(2,4,6-trimethylbenzoyl)- Chemical and Physical Properties
Names and Identifiers
-
- 1H-Imidazole, 1-(2,4,6-trimethylbenzoyl)-
- imidazol-1-yl-(2,4,6-trimethylphenyl)methanone
- (1H-Imidazol-1-yl)(mesityl)methanone
- (1H-Imidazol-1-yl)(2,4,6-trimethylphenyl)methanone
- DTXSID30511477
- N-(2,4,6-trimethylbenzoyl)-imidazole
- SCHEMBL10816537
- 81325-25-9
- WVCUKHRGOMTDKS-UHFFFAOYSA-N
-
- Inchi： 1S/C13H14N2O/c1-9-6-10(2)12(11(3)7-9)13(16)15-5-4-14-8-15/h4-8H,1-3H3
- InChI Key： WVCUKHRGOMTDKS-UHFFFAOYSA-N
- SMILES： O=C(C1C(C)=CC(C)=CC=1C)N1C=NC=C1
Computed Properties
- Exact Mass: 214.110613074g/mol
- Monoisotopic Mass: 214.110613074g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 16
- Rotatable Bond Count: 1
- Complexity: 255
- 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
- XLogP3: 2.6
- Topological Polar Surface Area: 34.9?2
1H-Imidazole, 1-(2,4,6-trimethylbenzoyl)- Related Literature
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Kay S. McMillan,Anthony G. McCluskey,Annette Sorensen,Marie Boyd,Michele Zagnoni Analyst, 2016,141, 100-110
-
Qiao Song,Angela Bamesberger,Lingyun Yang,Haley Houtwed,Haishi Cao Analyst, 2014,139, 3588-3592
-
Maomao Hou,Fenglin Zhong,Qiu Jin,Enjiang Liu,Jie Feng,Tengyun Wang,Yue Gao RSC Adv., 2017,7, 34392-34400
81325-25-9 (1H-Imidazole, 1-(2,4,6-trimethylbenzoyl)-) Related Products
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