Cas no 119389-21-8 (1H-Benzimidazole-2-carboxaldehyde,1-ethyl-5-fluoro-)
119389-21-8 structure
Product Name:1H-Benzimidazole-2-carboxaldehyde,1-ethyl-5-fluoro-
CAS No:119389-21-8
MF:C10H9FN2O
MW:192.189665555954
CID:133059
PubChem ID:21286292
Update Time:2025-04-19
1H-Benzimidazole-2-carboxaldehyde,1-ethyl-5-fluoro- Chemical and Physical Properties
Names and Identifiers
-
- 1H-Benzimidazole-2-carboxaldehyde,1-ethyl-5-fluoro-
- 1H-Benzimidazole-2-carboxaldehyde,1-ethyl-5-fluoro-(9CI)
- 119389-21-8
- SCHEMBL10642457
- 1-Ethyl-5-fluorobenzimidazole-2-carbaldehyde
- AKOS013083503
- 1-ethyl-5-fluoro-1H-benzo[d]imidazole-2-carbaldehyde
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- Inchi： 1S/C10H9FN2O/c1-2-13-9-4-3-7(11)5-8(9)12-10(13)6-14/h3-6H,2H2,1H3
- InChI Key： OKLQVRNJDJBKIX-UHFFFAOYSA-N
- SMILES： FC1C=CC2=C(C=1)N=C(C=O)N2CC
Computed Properties
- Exact Mass: 192.06997
- Monoisotopic Mass: 192.07
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 14
- Rotatable Bond Count: 2
- Complexity: 224
- 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
- Topological Polar Surface Area: 34.9A^2
- XLogP3: 1.6
Experimental Properties
- PSA: 34.89
- LogP: 2.00780
1H-Benzimidazole-2-carboxaldehyde,1-ethyl-5-fluoro- Related Literature
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Kay S. McMillan,Anthony G. McCluskey,Annette Sorensen,Marie Boyd,Michele Zagnoni Analyst, 2016,141, 100-110
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Eric Besson,Stéphane Gastaldi,Emily Bloch,Selma Aslan,Hakim Karoui,Olivier Ouari,Micael Hardy Analyst, 2019,144, 4194-4203
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Long Deng,Qian Zou,Biao Liu,Wenhui Ye,Chengfei Zhuo,Li Chen,Ze-Yuan Deng,Ya-Wei Fan,Jing Li Food Funct., 2018,9, 4234-4245
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Sowmyalakshmi Venkataraman RSC Adv., 2015,5, 73807-73813
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