Cas no 220677-27-0 (Ethyl 3-bromo-N-(3,4-dichlorobenzyl)indole-2-carboxylate)
220677-27-0 structure
Product Name:Ethyl 3-bromo-N-(3,4-dichlorobenzyl)indole-2-carboxylate
CAS No:220677-27-0
MF:C18H14BrCl2NO2
MW:427.119262218475
CID:2146523
Update Time:2023-08-04
Ethyl 3-bromo-N-(3,4-dichlorobenzyl)indole-2-carboxylate Chemical and Physical Properties
Names and Identifiers
-
- ethyl 3-bromo-N-(3,4-dichlorobenzyl)indole-2-carboxylate
- MBPGDUZEBODBNA-UHFFFAOYSA-N
- Ethyl 3-bromo-N-(3,4-dichlorobenzyl)indole-2-carboxylate
-
- Inchi： 1S/C18H14BrCl2NO2/c1-2-24-18(23)17-16(19)12-5-3-4-6-15(12)22(17)10-11-7-8-13(20)14(21)9-11/h3-9H,2,10H2,1H3
- InChI Key： MBPGDUZEBODBNA-UHFFFAOYSA-N
- SMILES： BrC1C2C=CC=CC=2N(C=1C(=O)OCC)CC1C=CC(=C(C=1)Cl)Cl
Computed Properties
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 24
- Rotatable Bond Count: 5
- Complexity: 453
- Topological Polar Surface Area: 31.2
Ethyl 3-bromo-N-(3,4-dichlorobenzyl)indole-2-carboxylate Related Literature
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Andre Prates Pereira,Tao Dong,Eric P. Knoshaug,Nick Nagle,Ryan Spiller,Bonnie Panczak,Christopher J. Chuck,Philip T. Pienkos Sustainable Energy Fuels, 2020,4, 3400-3408
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Xiang Liu,Qian Sun,A. B. Djuri?i?,Maohai Xie,Baohu Dai,Jinyao Tang,Charles Surya,Changzhong Liao,Kaimin Shih RSC Adv., 2015,5, 100783-100789
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Cheng Fang,Jinjian Wu,Zahra Sobhani,Md. Al Amin,Youhong Tang Anal. Methods, 2019,11, 163-170
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Haitao Li,Yu Pan,Zhizhi Wang,Shan Chen,Ruixin Guo,Jianqiu Chen RSC Adv., 2015,5, 100775-100782
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Luis Miguel Azofra,Douglas R. MacFarlane,Chenghua Sun Chem. Commun., 2016,52, 3548-3551
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