Cas no 98892-74-1 (1H-Imidazolium,1,2-dimethyl-3-propyl-, chloride (1:1))
98892-74-1 structure
Product Name:1H-Imidazolium,1,2-dimethyl-3-propyl-, chloride (1:1)
CAS No:98892-74-1
MF:C8H15ClN2
MW:174.671100854874
CID:803511
PubChem ID:13751980
Update Time:2025-04-19
1H-Imidazolium,1,2-dimethyl-3-propyl-, chloride (1:1) Chemical and Physical Properties
Names and Identifiers
-
- 1H-Imidazolium,1,2-dimethyl-3-propyl-, chloride (1:1)
- 1,2-dimethyl-3-propylimidazol-1-ium,chloride
- 1,2-DIMETHYL-3-PROPYLIMIDAZOLIUM CHLORIDE
- 1,2-dimethyl-3-propylimidazol-1-ium
- 1,2-dimethyl-3-propylimidazol-1-ium;chloride
- SCHEMBL1884665
- 1,2-dimethyl-3-propyl-1H-imidazol-3-ium chloride
- 1-propyl-2,3-dimethylimidazolium chloride
- 98892-74-1
- 2,3-Dimethyl-1-propyl-1H-imidazol-3-ium chloride
- AKOS006331150
- DTXSID80548430
-
- Inchi： 1S/C8H15N2.ClH/c1-4-5-10-7-6-9(3)8(10)2;/h6-7H,4-5H2,1-3H3;1H/q+1;/p-1
- InChI Key： OJIJIFAYAIXTGP-UHFFFAOYSA-M
- SMILES： [Cl-].N1(C=C[N+](C)=C1C)CCC
Computed Properties
- Exact Mass: 174.09200
- Monoisotopic Mass: 174.0923762g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 11
- Rotatable Bond Count: 2
- Complexity: 103
- Covalently-Bonded Unit Count: 2
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 8.8?2
Experimental Properties
- PSA: 8.81000
- LogP: -1.96500
1H-Imidazolium,1,2-dimethyl-3-propyl-, chloride (1:1) Related Literature
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Yukiya Kitayama Polym. Chem., 2014,5, 2784-2792
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Jason Wan Lab Chip, 2020,20, 4528-4538
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Gaurav J. Shah,Eric P.-Y. Chiou,Ming C. Wu,Chang-Jin “CJ” Kim Lab Chip, 2009,9, 1732-1739
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Yaling Zhang,Chunhui Dai,Shiwei Zhou,Bin Liu Chem. Commun., 2018,54, 10092-10095
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Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
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