Cas no 24780-84-5 (1H-Benzimidazole,1,2,5-trimethyl-)
24780-84-5 structure
Product Name:1H-Benzimidazole,1,2,5-trimethyl-
CAS No:24780-84-5
MF:C10H12N2
MW:160.215682029724
CID:240965
PubChem ID:14903317
Update Time:2025-04-19
1H-Benzimidazole,1,2,5-trimethyl- Chemical and Physical Properties
Names and Identifiers
-
- 1H-Benzimidazole,1,2,5-trimethyl-
- Benzimidazole,1,2,5-trimethyl- (8CI)
- 1.2.5-trimethyl-benzimidazole
- SCHEMBL1104855
- 24780-84-5
- 1,2,5-Trimethyl-1H-benzo[d]imidazole
- 1,2,5-trimethylbenzimidazole
-
- Inchi： 1S/C10H12N2/c1-7-4-5-10-9(6-7)11-8(2)12(10)3/h4-6H,1-3H3
- InChI Key： LPBNGTROYDCENQ-UHFFFAOYSA-N
- SMILES： N1(C)C(C)=NC2C=C(C)C=CC1=2
Computed Properties
- Exact Mass: 160.10016
- Monoisotopic Mass: 160.100048391g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 12
- Rotatable Bond Count: 0
- Complexity: 169
- 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: 2.2
- Topological Polar Surface Area: 17.8?2
Experimental Properties
- PSA: 17.82
1H-Benzimidazole,1,2,5-trimethyl- Related Literature
-
Jingquan Liu,Huiyun Liu,Zhongfan Jia,Volga Bulmus,Thomas P. Davis Chem. Commun., 2008, 6582-6584
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Bidyut Kumar Kundu,Rinky Singh,Ritudhwaj Tiwari,Debasis Nayak New J. Chem., 2019,43, 4867-4877
-
Siquan Zhang,Shengyao Wang,Liping Guo,Hao Chen,Bien Tan,Shangbin Jin J. Mater. Chem. C, 2020,8, 192-200
-
Teresita Carrillo-Hernández,Philippe Schaeffer,Pierre Albrecht Chem. Commun., 2001, 1976-1977
-
Stephen P. Fletcher,Richard B. C. Jagt,Ben L. Feringa Chem. Commun., 2007, 2578-2580
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