Cas no 5523-13-7 (2-[(1-propyl-1H-benzimidazol-2-yl)amino]ethanol)
5523-13-7 structure
Product Name:2-[(1-propyl-1H-benzimidazol-2-yl)amino]ethanol
CAS No:5523-13-7
MF:C12H17N3O
MW:219.282882452011
CID:1595396
PubChem ID:2849631
Update Time:2025-04-21
2-[(1-propyl-1H-benzimidazol-2-yl)amino]ethanol Chemical and Physical Properties
Names and Identifiers
-
- 2-[(1-propyl-1H-benzimidazol-2-yl)amino]ethanol
- Ethanol, 2-[(1-propyl-1H-benzimidazol-2-yl)amino]-
- CS-0216575
- DTXSID20970554
- ALBB-017607
- LS-05779
- MLS000595352
- 5523-13-7
- Oprea1_197316
- 2-[(1-propylbenzimidazol-2-yl)amino]ethanol
- 2-((1-Propyl-1H-benzo[d]imidazol-2-yl)amino)ethanol
- Z57299366
- AKOS002255606
- 111678-86-5
- BIM-0022502.P001
- CHEMBL1517899
- STK008519
- 2-[(1-Propyl-1,3-dihydro-2H-benzimidazol-2-ylidene)amino]ethan-1-ol
- SMR000149875
- 2-[(1-propyl-1H-1,3-benzodiazol-2-yl)amino]ethan-1-ol
- EN300-51640
- Cambridge id 5523137
- 2-(1-Propyl-1H-benzoimidazol-2-ylamino)-ethanol
- G42749
- HMS2486N22
- CCG-9730
- MFCD01136089
- CBMicro_022644
-
- Inchi: 1S/C12H17N3O/c1-2-8-15-11-6-4-3-5-10(11)14-12(15)13-7-9-16/h3-6,16H,2,7-9H2,1H3,(H,13,14)
- InChI Key: UKANTQXTRJQTAF-UHFFFAOYSA-N
- SMILES: OCCNC1=NC2C=CC=CC=2N1CCC
Computed Properties
- Exact Mass: 219.13731
- Monoisotopic Mass: 219.137
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 16
- Rotatable Bond Count: 5
- Complexity: 212
- 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: 1.9
- Topological Polar Surface Area: 50.1?2
Experimental Properties
- Density: 1.18
- Boiling Point: 399.2°C at 760 mmHg
- Flash Point: 195.2°C
- Refractive Index: 1.6
- PSA: 50.08
2-[(1-propyl-1H-benzimidazol-2-yl)amino]ethanol Related Literature
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S. Amaresh,K. Karthikeyan,K. J. Kim,Y. S. Lee RSC Adv., 2014,4, 23107-23115
-
Ni-Na Sun,Fengli Qu,Xiaobing Zhang,Shufang Zhang,Jinmao You Analyst, 2015,140, 1827-1831
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Eunhak Lim,Jiyoung Heo,Seong Keun Kim Nanoscale, 2019,11, 11369-11378
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P. K. Wawrzyniak,M. T. P. Beerepoot,H. J. M. de Groot,F. Buda Phys. Chem. Chem. Phys., 2011,13, 10270-10279
-
Haitao Li,Yu Pan,Zhizhi Wang,Shan Chen,Ruixin Guo,Jianqiu Chen RSC Adv., 2015,5, 100775-100782
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