4-(N-Methylsulfamoyl)phenylboronic Acid - CAS 226396-31-2
Catalog: |
BB017693 |
Product Name: |
4-(N-Methylsulfamoyl)phenylboronic Acid |
CAS: |
226396-31-2 |
Synonyms: |
[4-(methylsulfamoyl)phenyl]boronic acid; [4-(methylsulfamoyl)phenyl]boronic acid |
IUPAC Name: | [4-(methylsulfamoyl)phenyl]boronic acid |
Description: | 4-(N-Methylsulfamoyl)phenylboronic Acid (CAS# 226396-31-2) is a useful research chemical. |
Molecular Weight: | 215.03 |
Molecular Formula: | C7H10NO4SB |
Canonical SMILES: | B(C1=CC=C(C=C1)S(=O)(=O)NC)(O)O |
InChI: | InChI=1S/C7H10BNO4S/c1-9-14(12,13)7-4-2-6(3-5-7)8(10)11/h2-5,9-11H,1H3 |
InChI Key: | DOQOQZHSIBBHMY-UHFFFAOYSA-N |
Boiling Point: | 418.9 °C at 760 mmHg |
Density: | 1.42 g/cm3 |
Appearance: | White solid |
LogP: | -0.25380 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
US-2020397697-A1 | Formulations of tie-2 activators and methods of use thereof | 20190624 |
US-2020361939-A1 | Modulators of alpha-1 antitrypsin | 20190514 |
WO-2020157491-A1 | G-a crosslinking cytotoxic agents | 20190129 |
WO-2020023393-A1 | Kinase antagonists and methods for making and using them | 20180723 |
TW-202012410-A | Kinase antagonist and its preparation and use method | 20180723 |
Complexity: | 266 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 215.0423591 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 3 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 215.0423591 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 95 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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