Cas no 69515-02-2 (Ethanone, 1-(2-methyl-1H-benzimidazol-4-yl)- (9CI))
69515-02-2 structure
Product Name:Ethanone, 1-(2-methyl-1H-benzimidazol-4-yl)- (9CI)
CAS No:69515-02-2
MF:C10H10N2O
MW:174.199202060699
CID:1057687
PubChem ID:21334345
Update Time:2025-04-20
Ethanone, 1-(2-methyl-1H-benzimidazol-4-yl)- (9CI) Chemical and Physical Properties
Names and Identifiers
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- Ethanone, 1-(2-methyl-1H-benzimidazol-4-yl)- (9CI)
- 1-(2-methyl-1H-benzimidazol-4-yl)ethanone
- 1-(2-methyl-1H-benzo[d]imidazol-4-yl)ethanone
- 69515-02-2
- SCHEMBL13544690
- 1-(2-Methyl-1H-benzimidazol-4-yl)ethan-1-one
- DTXSID30612599
- DB-286966
- ETHANONE, 1-(2-METHYL-1H-BENZIMIDAZOL-4-YL)-
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- Inchi： 1S/C10H10N2O/c1-6(13)8-4-3-5-9-10(8)12-7(2)11-9/h3-5H,1-2H3,(H,11,12)
- InChI Key： UBXWXFQDWRLUEZ-UHFFFAOYSA-N
- SMILES： O=C(C)C1=CC=CC2=C1N=C(C)N2
Computed Properties
- Exact Mass: 174.079312947g/mol
- Monoisotopic Mass: 174.079312947g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 13
- Rotatable Bond Count: 1
- Complexity: 217
- 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: 1.5
- Topological Polar Surface Area: 45.8?2
Ethanone, 1-(2-methyl-1H-benzimidazol-4-yl)- (9CI) Related Literature
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1. Excimer emission and magnetoluminescence of radical-based zinc(ii) complexes doped in host crystals?Shojiro Kimura,Tetsuro Kusamoto Chem. Commun., 2020,56, 11195-11198
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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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3. Fatty acid eutectic mixtures and derivatives from non-edible animal fat as phase change materials?Pau Gallart-Sirvent,Marc Martín,Gemma Villorbina,Mercè Balcells,Aran Solé,Luisa F. Cabeza,Ramon Canela-Garayoa RSC Adv., 2017,7, 24133-24139
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Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
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Tao Wang,Yangyang Liu,Yue Deng,Hongbo Fu,Jianmin Chen Environ. Sci.: Nano, 2018,5, 1821-1833
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