Cas no 37455-61-1 (1H-Imidazole, 2,4-bis(1-methylethyl)-)
37455-61-1 structure
Product Name:1H-Imidazole, 2,4-bis(1-methylethyl)-
CAS No:37455-61-1
MF:C9H16N2
MW:152.236742019653
CID:1483523
PubChem ID:12199462
Update Time:2025-04-21
1H-Imidazole, 2,4-bis(1-methylethyl)- Chemical and Physical Properties
Names and Identifiers
-
- 1H-Imidazole, 2,4-bis(1-methylethyl)-
- 2,5-di(propan-2-yl)-1H-imidazole
- DTXSID30480134
- 37455-61-1
- SCHEMBL786437
- XIODJABKYXBISG-UHFFFAOYSA-N
-
- Inchi： 1S/C9H16N2/c1-6(2)8-5-10-9(11-8)7(3)4/h5-7H,1-4H3,(H,10,11)
- InChI Key： XIODJABKYXBISG-UHFFFAOYSA-N
- SMILES： N1C(C(C)C)=NC=C1C(C)C
Computed Properties
- Exact Mass: 152.13148
- Monoisotopic Mass: 152.131348519g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 11
- Rotatable Bond Count: 2
- Complexity: 121
- 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: 2.4
- Topological Polar Surface Area: 28.7?2
Experimental Properties
- PSA: 28.68
1H-Imidazole, 2,4-bis(1-methylethyl)- Related Literature
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Alexandre Vimont,Arnaud Travert,Philippe Bazin,Jean-Claude Lavalley,Marco Daturi,Christian Serre,Gérard Férey,Sandrine Bourrelly,Philip L. Llewellyn Chem. Commun., 2007, 3291-3293
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Qiyuan Wu,Shangmin Xiong,Peichuan Shen,Shen Zhao,Alexander Orlov Catal. Sci. Technol., 2015,5, 2059-2064
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Xing Zhao,Lu Bai,Rui-Ying Bao,Zheng-Ying Liu,Ming-Bo Yang,Wei Yang RSC Adv., 2017,7, 46297-46305
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Byungho Lim,Jaewon Jin,Jin Yoo,Seung Yong Han,Kyeongyeol Kim,Sungah Kang,Nojin Park,Sang Moon Lee,Hae Jin Kim,Seung Uk Son Chem. Commun., 2014,50, 7723-7726
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Dan Yang,Yanping Zhou,Xianhong Rui,Jixin Zhu,Ziyang Lu,Eileen Fong,Qingyu Yan RSC Adv., 2013,3, 14960-14962
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