2-Chloro-4-nitrophenylboronic acid - CAS 1436612-57-5
Catalog: |
BB062456 |
Product Name: |
2-Chloro-4-nitrophenylboronic acid |
CAS: |
1436612-57-5 |
Synonyms: |
B-(2-Chloro-4-nitrophenyl)boronic Acid |
IUPAC Name: | (2-chloro-4-nitrophenyl)boronic acid |
Description: | 2-Chloro-4-nitrophenylboronic Acid is a useful research chemical for organic synthesis and other chemical processes. |
Molecular Weight: | 201.37 |
Molecular Formula: | C6H5BClNO4 |
Canonical SMILES: | B(C1=C(C=C(C=C1)[N+](=O)[O-])Cl)(O)O |
InChI: | InChI=1S/C6H5BClNO4/c8-6-3-4(9(12)13)1-2-5(6)7(10)11/h1-3,10-11H |
InChI Key: | UQGPTZONRAXNDF-UHFFFAOYSA-N |
References: | Kamble, R. B., et al. New J. Chem., 43, 1632 (2019); Bommegowda, Y. K., et al. Chem. Lett., 45, 268 (2016). |
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 |
CA-3022395-A1 | Di-substituted pyrazole compounds for the treatment of diseases | 20160429 |
EP-3448851-A1 | Di-substituted pyrazole compounds for the treatment of diseases | 20160429 |
US-2019134017-A1 | Di-substituted pyrazole compounds for the treatment of diseases | 20160429 |
WO-2017190086-A1 | Di-substituted pyrazole compounds for the treatment of diseases | 20160429 |
AU-2017258781-B2 | Di-substituted pyrazole compounds for the treatment of diseases | 20160429 |
CN-109476635-B | Disubstituted pyrazoles for treatment of diseases | 20160429 |
AU-2017258781-C1 | Di-substituted pyrazole compounds for the treatment of diseases | 20160429 |
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AU-2013337370-B2 | Cyclic sulfonamide containing derivatives as inhibitors of hedgehog signaling pathway | 20121105 |
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Complexity: | 198 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 201.0000155 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 201.0000155 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 86.3Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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