Cas no 113698-36-5 (1H-Imidazole,4,5-dihydro-2-(2-naphthalenyl)-)
113698-36-5 structure
Product Name:1H-Imidazole,4,5-dihydro-2-(2-naphthalenyl)-
CAS No:113698-36-5
MF:C13H12N2
MW:196.247782707214
CID:143644
PubChem ID:11769428
Update Time:2025-04-19
1H-Imidazole,4,5-dihydro-2-(2-naphthalenyl)- Chemical and Physical Properties
Names and Identifiers
-
- 1H-Imidazole,4,5-dihydro-2-(2-naphthalenyl)-
- BENAZOLINE
- 4,5-Dihydro-2-(2-naphthalenyl)-1H-imidazole oxalate salt
- BENAZOLINE OXALATE
- 4,5-Dihydro-2-(2-naphthalenyl)-1H-imidazole oxalate salt
- SCHEMBL9575180
- 113698-36-5
- 2-naphthalen-2-yl-4,5-dihydro-1H-imidazole
- DTXSID8048442
- 2-(naphthalen-2-yl)-4,5-dihydro-1H-imidazole
- CHEMBL266155
- BDBM50240366
- BGWRJAXPPYHIRG-UHFFFAOYSA-N
-
- Inchi： 1S/C13H12N2/c1-2-4-11-9-12(6-5-10(11)3-1)13-14-7-8-15-13/h1-6,9H,7-8H2,(H,14,15)
- InChI Key： BGWRJAXPPYHIRG-UHFFFAOYSA-N
- SMILES： N1CCN=C1C1C=CC2C=CC=CC=2C=1
Computed Properties
- Exact Mass: 242.97578
- Monoisotopic Mass: 196.100048391g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 15
- Rotatable Bond Count: 1
- Complexity: 259
- 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: 2.1
- Topological Polar Surface Area: 24.4?2
Experimental Properties
- Solubility: H2O: ≤8?mg/mL
- PSA: 57.61
1H-Imidazole,4,5-dihydro-2-(2-naphthalenyl)- Related Literature
-
Norihito Fukui,Keisuke Fujimoto,Hideki Yorimitsu,Atsuhiro Osuka Dalton Trans., 2017,46, 13322-13341
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Yaling Zhang,Chunhui Dai,Shiwei Zhou,Bin Liu Chem. Commun., 2018,54, 10092-10095
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Yi Cao,Yujiao Xiahou,Lixiang Xing,Xiang Zhang,Hong Li,ChenShou Wu,Haibing Xia Nanoscale, 2020,12, 20456-20466
-
Peiyuan Zeng,Xiaoxiao Wang,Ming Ye,Qiuyang Ma,Jianwen Li,Wanwan Wang,Baoyou Geng,Zhen Fang RSC Adv., 2016,6, 23074-23084
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Liao Xiaoqing,Li Ruiyi,Li Zaijun,Sun Xiulan,Wang Zhouping,Liu Junkang New J. Chem., 2015,39, 5240-5248
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