Cas no 108512-03-4 (1-[2-(1-methylethyl)-1H-imidazol-5-yl]-Ethanone)
![1-[2-(1-methylethyl)-1H-imidazol-5-yl]-Ethanone structure](https://ossimg.kuujia.com/scimg/109000/108512-03-4x500.png)
108512-03-4 structure
Product Name:1-[2-(1-methylethyl)-1H-imidazol-5-yl]-Ethanone
CAS No:108512-03-4
MF:C8H12N2O
MW:152.193681716919
CID:1098351
PubChem ID:13804283
Update Time:2025-04-20
1-[2-(1-methylethyl)-1H-imidazol-5-yl]-Ethanone Chemical and Physical Properties
Names and Identifiers
-
- 1-[2-(1-methylethyl)-1H-imidazol-5-yl]-Ethanone
- Ethanone, 1-[2-(1-methylethyl)-1H-imidazol-4-yl]- (9CI)
- 108512-03-4
- 1-(2-propan-2-yl-1H-imidazol-5-yl)ethanone
- 2-Isopropyl-4-acetyl-1H-imidazole
- ETHANONE, 1-[2-(1-METHYLETHYL)-1H-IMIDAZOL-4-YL]-
- SCHEMBL5784712
- DB-287199
-
- Inchi： 1S/C8H12N2O/c1-5(2)8-9-4-7(10-8)6(3)11/h4-5H,1-3H3,(H,9,10)
- InChI Key： RHQWKIDPKKQJHQ-UHFFFAOYSA-N
- SMILES： O=C(C)C1=CN=C(C(C)C)N1
Computed Properties
- Exact Mass: 151.08723
- Monoisotopic Mass: 152.094963011g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 11
- Rotatable Bond Count: 2
- Complexity: 156
- 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: 1.2
- Topological Polar Surface Area: 45.8?2
Experimental Properties
- PSA: 42.85
1-[2-(1-methylethyl)-1H-imidazol-5-yl]-Ethanone Related Literature
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1. Fatty acid eutectic mixtures and derivatives from non-edible animal fat as phase change materials?Pau Gallart-Sirvent,Marc Martín,Gemma Villorbina,Mercè Balcells,Aran Solé,Luisa F. Cabeza,Ramon Canela-Garayoa RSC Adv., 2017,7, 24133-24139
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David White,Sean R. Stowell Biomater. Sci., 2017,5, 463-474
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Long Deng,Qian Zou,Biao Liu,Wenhui Ye,Chengfei Zhuo,Li Chen,Ze-Yuan Deng,Ya-Wei Fan,Jing Li Food Funct., 2018,9, 4234-4245
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Ji-Ping Wei Nanoscale, 2015,7, 11815-11832
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J. Xu,T. J. Carrocci,A. A. Hoskins Chem. Commun., 2016,52, 549-552
108512-03-4 (1-[2-(1-methylethyl)-1H-imidazol-5-yl]-Ethanone) Related Products
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