1H-Indole, 1-methyl-7-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)- - CAS 903499-35-4
Catalog: |
BB060707 |
Product Name: |
1H-Indole, 1-methyl-7-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)- |
CAS: |
903499-35-4 |
Synonyms: |
1-Methyl-7-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-indole; 1-methyl-7-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)indole; (1-METHYL-1H-INDOL-7-YL)BORONIC ACID PINACOL ESTER; 1H-Indole, 1-methyl-7-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)- |
IUPAC Name: | 1-methyl-7-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)indole |
Description: | 1H-Indole, 1-methyl-7-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)- |
Molecular Weight: | 257.14 |
Molecular Formula: | C15H20BNO2 |
Canonical SMILES: | B1(OC(C(O1)(C)C)(C)C)C2=C3C(=CC=C2)C=CN3C |
InChI: | InChI=1S/C15H20BNO2/c1-14(2)15(3,4)19-16(18-14)12-8-6-7-11-9-10-17(5)13(11)12/h6-10H,1-5H3 |
InChI Key: | SWOGXWISGFKQRK-UHFFFAOYSA-N |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
WO-2021023813-A1 | 5-heteroaryl-pyridin-2-amine confounds as neuropeptide ff receptor antagonists | 20190806 |
US-2020102303-A1 | Monoacylglycerol Lipase Modulators | 20180928 |
BR-112021005896-A2 | monoacylglycerol lipase modulators | 20180928 |
CN-113164459-A | Monoacylglycerol lipase modulators | 20180928 |
IL-281812-D0 | Monoacylglycerol lipase modulators | 20180928 |
AU-2015407300-A1 | 2-Arylamino pyridine, pyridine or triazine derivative, preparation method and use thereof | 20150831 |
EP-3345906-A1 | 2-arylamino pyridine, pyridine or triazine derivative, preparation method and use thereof | 20150831 |
JP-2018525431-A | 2-Arylaminopyridine, pyrimidine or triazine derivatives and their production and use | 20150831 |
JP-6606278-B2 | 2-Arylaminopyridine, pyrimidine or triazine derivatives and their production and use | 20150831 |
KR-102051609-B1 | 2-arylaminopyridine, pyrimidine or triazine derivatives and methods for their preparation and use | 20150831 |
Complexity: | 342 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 257.158709 |
Formal Charge: | 0 |
Heavy Atom Count: | 19 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 257.158709 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 23.4Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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