2-(Dimethylcarbamoyl)phenylboronic Acid - CAS 874219-16-6
Catalog: |
BB038432 |
Product Name: |
2-(Dimethylcarbamoyl)phenylboronic Acid |
CAS: |
874219-16-6 |
Synonyms: |
[2-[dimethylamino(oxo)methyl]phenyl]boronic acid; [2-(dimethylcarbamoyl)phenyl]boronic acid |
IUPAC Name: | [2-(dimethylcarbamoyl)phenyl]boronic acid |
Description: | 2-(Dimethylcarbamoyl)phenylboronic Acid (CAS# 874219-16-6) is a useful research chemical. |
Molecular Weight: | 193.01 |
Molecular Formula: | C9H12NO3B |
Canonical SMILES: | B(C1=CC=CC=C1C(=O)N(C)C)(O)O |
InChI: | InChI=1S/C9H12BNO3/c1-11(2)9(12)7-5-3-4-6-8(7)10(13)14/h3-6,13-14H,1-2H3 |
InChI Key: | NZIOVLXULSCCSG-UHFFFAOYSA-N |
Boiling Point: | 417.8 °C at 760 mmHg |
Density: | 1.2 g/cm3 |
LogP: | -0.93180 |
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 |
US-2019374542-A1 | Kras g12c inhibitors and methods of using the same | 20180612 |
BR-112020012635-A2 | aminopyridine derivatives as phosphatidylinositol phosphate kinase inhibitors | 20171222 |
CA-3070013-A1 | Substituted pyrrolopyridine-derivatives | 20170718 |
Complexity: | 208 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 193.0910234 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 193.0910234 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 60.8 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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