Cas no 3991-75-1 (1H-imidazol-1-yl(2-methylphenyl)-Methanone)
3991-75-1 structure
Product Name:1H-imidazol-1-yl(2-methylphenyl)-Methanone
CAS No:3991-75-1
MF:C11H10N2O
MW:186.20990228653
CID:1111980
PubChem ID:53423590
Update Time:2025-04-20
1H-imidazol-1-yl(2-methylphenyl)-Methanone Chemical and Physical Properties
Names and Identifiers
-
- 1H-imidazol-1-yl(2-methylphenyl)-Methanone
- 3991-75-1
- 1H-Imidazol-1-yl(2-methylphenyl)methanone
- DTXSID201269635
- SCHEMBL15763697
-
- Inchi： 1S/C11H10N2O/c1-9-4-2-3-5-10(9)11(14)13-7-6-12-8-13/h2-8H,1H3
- InChI Key： IWZWQYWYFAOUOZ-UHFFFAOYSA-N
- SMILES： O=C(C1C=CC=CC=1C)N1C=NC=C1
Computed Properties
- Exact Mass: 186.0794
- Monoisotopic Mass: 186.079312947g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 14
- Rotatable Bond Count: 1
- Complexity: 217
- 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: 1.9
- Topological Polar Surface Area: 34.9?2
Experimental Properties
- PSA: 34.89
1H-imidazol-1-yl(2-methylphenyl)-Methanone Related Literature
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Hyejin Moon,Aaron R. Wheeler,Robin L. Garrell,Chang-Jin “CJ” Kim Lab Chip, 2006,6, 1213-1219
-
Luke L. Lairson,Warren W. Wakarchuk Chem. Commun., 2007, 365-367
-
Xiaofeng Lin RSC Adv., 2016,6, 9002-9006
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Benjamin Gabriel Poulson,Kacper Szczepski,Joanna Izabela Lachowicz,Lukasz Jaremko,Abdul-Hamid Emwas,Mariusz Jaremko RSC Adv., 2020,10, 215-227
3991-75-1 (1H-imidazol-1-yl(2-methylphenyl)-Methanone) Related Products
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