Cas no 912455-27-7 (1H-Imidazole, 2-butyl-4,5-dimethyl-)
912455-27-7 structure
Product Name:1H-Imidazole, 2-butyl-4,5-dimethyl-
CAS No:912455-27-7
MF:C9H16N2
MW:152.236742019653
CID:996111
PubChem ID:45120634
Update Time:2025-04-20
1H-Imidazole, 2-butyl-4,5-dimethyl- Chemical and Physical Properties
Names and Identifiers
-
- 1H-Imidazole, 2-butyl-4,5-dimethyl-
- 1H-Imidazole,2-butyl-4,5-dimethyl-
- SCHEMBL9381916
- 912455-27-7
-
- Inchi： 1S/C9H16N2/c1-4-5-6-9-10-7(2)8(3)11-9/h4-6H2,1-3H3,(H,10,11)
- InChI Key： JYBLQBKTEAJZGV-UHFFFAOYSA-N
- SMILES： N1C(C)=C(C)N=C1CCCC
Computed Properties
- Exact Mass: 152.131348519g/mol
- 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: 3
- Complexity: 114
- 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: 28.7?2
1H-Imidazole, 2-butyl-4,5-dimethyl- Related Literature
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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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Aloke Das,K. K. Mahato,Chayan K. Nandi,Tapas Chakraborty,Shridhar R. Gadre,Nikhil A. Gokhale Phys. Chem. Chem. Phys., 2002,4, 2162-2168
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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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Guang Xu,Wei Zhang,Ying Zhang,Xiaoxia Zhao,Ping Wen,Di Ma RSC Adv., 2018,8, 19353-19361
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Saeideh Mirfakhraei,Malak Hekmati,Fereshteh Hosseini Eshbala,Hojat Veisi New J. Chem., 2018,42, 1757-1761
912455-27-7 (1H-Imidazole, 2-butyl-4,5-dimethyl-) Related Products
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