Cas no 161823-50-3 (1,3-Dioctyl-1,3-dihydro-2H-benzimidazol-2-one)
161823-50-3 structure
Product Name:1,3-Dioctyl-1,3-dihydro-2H-benzimidazol-2-one
CAS No:161823-50-3
MF:C23H38N2O
MW:358.560626506805
CID:2780463
PubChem ID:21468504
Update Time:2025-04-21
1,3-Dioctyl-1,3-dihydro-2H-benzimidazol-2-one Chemical and Physical Properties
Names and Identifiers
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- 1,3-Dioctyl-1,3-dihydro-2H-benzimidazol-2-one
- DTXSID00614328
- 161823-50-3
- SCHEMBL8862370
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- Inchi： 1S/C23H38N2O/c1-3-5-7-9-11-15-19-24-21-17-13-14-18-22(21)25(23(24)26)20-16-12-10-8-6-4-2/h13-14,17-18H,3-12,15-16,19-20H2,1-2H3
- InChI Key： YPZSSMRUWCABBG-UHFFFAOYSA-N
- SMILES： O=C1N(C2C=CC=CC=2N1CCCCCCCC)CCCCCCCC
Computed Properties
- Exact Mass: 358.298413840Da
- Monoisotopic Mass: 358.298413840Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 26
- Rotatable Bond Count: 14
- Complexity: 350
- 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: 7.8
- Topological Polar Surface Area: 23.6?2
1,3-Dioctyl-1,3-dihydro-2H-benzimidazol-2-one Related Literature
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Qiaoe Wang,Meiling Lian,Xiaowen Zhu,Xu Chen RSC Adv., 2021,11, 192-197
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Yi Cao,Yujiao Xiahou,Lixiang Xing,Xiang Zhang,Hong Li,ChenShou Wu,Haibing Xia Nanoscale, 2020,12, 20456-20466
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Joo Chuan Yeo,Kenry Lab Chip, 2016,16, 4082-4090
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Chung-Sung Yang,Mong-Shian Shih,Fang-Yi Chang New J. Chem., 2006,30, 729-735
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Ji-Ping Wei Nanoscale, 2015,7, 11815-11832
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