Cas no 62366-41-0 (Methanone, bis(1-propyl-1H-imidazol-2-yl)-)
62366-41-0 structure
Product Name:Methanone, bis(1-propyl-1H-imidazol-2-yl)-
CAS No:62366-41-0
MF:C13H18N4O
MW:246.308222293854
CID:447816
PubChem ID:12325294
Update Time:2025-04-19
Methanone, bis(1-propyl-1H-imidazol-2-yl)- Chemical and Physical Properties
Names and Identifiers
-
- Methanone, bis(1-propyl-1H-imidazol-2-yl)-
- bis(1-propylimidazol-2-yl)methanone
- Bis(1-propyl-1H-imidazol-2-yl)methanone
- 62366-41-0
- DTXSID40489416
-
- Inchi： 1S/C13H18N4O/c1-3-7-16-9-5-14-12(16)11(18)13-15-6-10-17(13)8-4-2/h5-6,9-10H,3-4,7-8H2,1-2H3
- InChI Key： RWCHWDQMNJGQAG-UHFFFAOYSA-N
- SMILES： O=C(C1=NC=CN1CCC)C1=NC=CN1CCC
Computed Properties
- Exact Mass: 246.14824
- Monoisotopic Mass: 246.14806121g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 18
- Rotatable Bond Count: 6
- Complexity: 258
- 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: 1.8
- Topological Polar Surface Area: 52.7?2
Experimental Properties
- PSA: 52.71
Methanone, bis(1-propyl-1H-imidazol-2-yl)- Related Literature
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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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Zhizhen Lai,Mo Zhang,Jinyu Zhou,Tianjing Chen,Dan Li,Xuejing Shen,Jia Liu,Jiang Zhou,Zhili Li Analyst, 2021,146, 4261-4267
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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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Saeideh Mirfakhraei,Malak Hekmati,Fereshteh Hosseini Eshbala,Hojat Veisi New J. Chem., 2018,42, 1757-1761
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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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