3-Sulfamoylphenylboronic Acid - CAS 850568-74-0
Catalog: |
BB037440 |
Product Name: |
3-Sulfamoylphenylboronic Acid |
CAS: |
850568-74-0 |
Synonyms: |
(3-sulfamoylphenyl)boronic acid; (3-sulfamoylphenyl)boronic acid |
IUPAC Name: | (3-sulfamoylphenyl)boronic acid |
Description: | 3-Sulfamoylphenylboronic Acid (CAS# 850568-74-0) is a useful research chemical. |
Molecular Weight: | 201.01 |
Molecular Formula: | C6H8NO4SB |
Canonical SMILES: | B(C1=CC(=CC=C1)S(=O)(=O)N)(O)O |
InChI: | InChI=1S/C6H8BNO4S/c8-13(11,12)6-3-1-2-5(4-6)7(9)10/h1-4,9-10H,(H2,8,11,12) |
InChI Key: | PMNJSWJJYWZLHU-UHFFFAOYSA-N |
Boiling Point: | 496.9 °C at 760 mmHg |
Density: | 1.53 g/cm3 |
Appearance: | White solid |
LogP: | -0.20510 |
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 |
EP-3878891-A1 | Dynamic covalent hydrogels, precursors thereof and uses thereof | 20200310 |
WO-2021180795-A1 | Dynamic covalent hydrogels, precursors thereof and uses thereof | 20200310 |
WO-2020242245-A1 | Phthalazinone compounds and use thereof | 20190529 |
US-2020003773-A1 | Optical detection of biological components | 20180405 |
WO-2019173761-A1 | C-abl tyrosine kinase inhibitory compound embodiments and methods of making and using the same | 20180309 |
Complexity: | 260 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 201.0267091 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 3 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 201.0267091 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 109 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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