Cas no 919119-60-1 (1H-Indole,5-chloro-2-methyl-7-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-)
919119-60-1 structure
Product Name:1H-Indole,5-chloro-2-methyl-7-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-
CAS No:919119-60-1
MF:C15H19BClNO2
MW:291.580863237381
CID:765538
PubChem ID:24960595
Update Time:2025-04-19
1H-Indole,5-chloro-2-methyl-7-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)- Chemical and Physical Properties
Names and Identifiers
-
- 1H-Indole,5-chloro-2-methyl-7-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-
- 5-Chloro-2-methyl-1H-indole-7-boronic acid pinacol ester
- 5-chloro-2-methyl-7-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-indole
- DTXSID30648075
- 919119-60-1
- FT-0759781
- A844098
-
- Inchi： 1S/C15H19BClNO2/c1-9-6-10-7-11(17)8-12(13(10)18-9)16-19-14(2,3)15(4,5)20-16/h6-8,18H,1-5H3
- InChI Key： CZGYEJPYWNMRCD-UHFFFAOYSA-N
- SMILES： ClC1C=C2C=C(C)NC2=C(B2OC(C)(C)C(C)(C)O2)C=1
Computed Properties
- Exact Mass: 291.12
- Monoisotopic Mass: 291.12
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 20
- Rotatable Bond Count: 1
- Complexity: 374
- 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
- Topological Polar Surface Area: 34.2A^2
Experimental Properties
- PSA: 34.25000
- LogP: 3.42890
1H-Indole,5-chloro-2-methyl-7-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)- Related Literature
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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
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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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Eric Besson,Stéphane Gastaldi,Emily Bloch,Selma Aslan,Hakim Karoui,Olivier Ouari,Micael Hardy Analyst, 2019,144, 4194-4203
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Yukiya Kitayama Polym. Chem., 2014,5, 2784-2792
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