Cas no 111678-90-1 (Ethanol,2-[[1-(phenylmethyl)-1H-benzimidazol-2-yl]amino]-, hydrochloride (1:1))
![Ethanol,2-[[1-(phenylmethyl)-1H-benzimidazol-2-yl]amino]-, hydrochloride (1:1) structure](https://ossimg.kuujia.com/scimg/112000/111678-90-1x500.png)
111678-90-1 structure
Product Name:Ethanol,2-[[1-(phenylmethyl)-1H-benzimidazol-2-yl]amino]-, hydrochloride (1:1)
CAS No:111678-90-1
MF:C16H18ClN3O
MW:303.786622524261
CID:162808
PubChem ID:3066875
Update Time:2025-04-19
Ethanol,2-[[1-(phenylmethyl)-1H-benzimidazol-2-yl]amino]-, hydrochloride (1:1) Chemical and Physical Properties
Names and Identifiers
-
- Ethanol,2-[[1-(phenylmethyl)-1H-benzimidazol-2-yl]amino]-, hydrochloride (1:1)
- 1-Benzyl-2-(2-hydroxyethylamino)benzimidazole hydrochloride
- 2-[(1-benzylbenzimidazol-2-yl)amino]ethanol,hydrochloride
- 2-((1-(Phenylmethyl)-1H-benzimidazol-2-yl)amino)ethanol monohydrochloride
- 2-[(1-benzyl-1H-benzimidazol-2-yl)amino]ethanol hydrochloride
- Ethanol, 2-((1-(phenylmethyl)-1H-benzimidazol-2-yl)amino)-, monohydrochloride
- 2-[(1-benzylbenzimidazol-2-yl)amino]ethanol;hydrochloride
- DTXSID80149704
- 111678-90-1
-
- Inchi： 1S/C16H17N3O.ClH/c20-11-10-17-16-18-14-8-4-5-9-15(14)19(16)12-13-6-2-1-3-7-13;/h1-9,20H,10-12H2,(H,17,18);1H
- InChI Key： YEQDAXKLBPHREW-UHFFFAOYSA-N
- SMILES： Cl.OCCNC1=NC2C=CC=CC=2N1CC1C=CC=CC=1
Computed Properties
- Exact Mass: 303.11404
- Monoisotopic Mass: 303.1138399g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 3
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 21
- Rotatable Bond Count: 5
- Complexity: 293
- 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: 50.1?2
Experimental Properties
- PSA: 50.08
Ethanol,2-[[1-(phenylmethyl)-1H-benzimidazol-2-yl]amino]-, hydrochloride (1:1) Related Literature
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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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Craig A. Kelly,David R. Rosseinsky Phys. Chem. Chem. Phys., 2001,3, 2086-2090
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Jacob S. Jordan,Evan R. Williams Analyst, 2021,146, 2617-2625
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Dhirendra K. Chaudhary,Pramendra Kumar,Lokendra Kumar RSC Adv., 2016,6, 94731-94738
-
Ivor Lon?ari? Phys. Chem. Chem. Phys., 2015,17, 9436-9445
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