4-(Cyclopropylcarbamoyl)phenylboronic Acid - CAS 860173-33-7
Catalog: |
BB037798 |
Product Name: |
4-(Cyclopropylcarbamoyl)phenylboronic Acid |
CAS: |
860173-33-7 |
Synonyms: |
[4-[(cyclopropylamino)-oxomethyl]phenyl]boronic acid; [4-(cyclopropylcarbamoyl)phenyl]boronic acid |
IUPAC Name: | [4-(cyclopropylcarbamoyl)phenyl]boronic acid |
Description: | 4-(Cyclopropylcarbamoyl)phenylboronic Acid (CAS# 860173-33-7 ) is a useful research chemical. |
Molecular Weight: | 205.02 |
Molecular Formula: | C10H12NO3B |
Canonical SMILES: | B(C1=CC=C(C=C1)C(=O)NC2CC2)(O)O |
InChI: | InChI=1S/C10H12BNO3/c13-10(12-9-5-6-9)7-1-3-8(4-2-7)11(14)15/h1-4,9,14-15H,5-6H2,(H,12,13) |
InChI Key: | WCRPDYXXIVYAAJ-UHFFFAOYSA-N |
LogP: | -0.35050 |
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 |
WO-2020210366-A1 | Condensed azines for ep300 or cbp modulation and indications therefor | 20190409 |
US-2021315872-A1 | COMPOUNDS AND METHODS FOR EP300 or CBP MODULATION AND INDICATIONS THEREFOR | 20190409 |
WO-2019138107-A1 | Inhibitors of indoleamine 2,3-dioxygenase and/or tryptophan 2,3-dioxygenase | 20180115 |
CN-111601810-A | Inhibitors of indoleamine 2, 3-dioxygenase and/or tryptophan 2, 3-dioxygenase | 20180115 |
EP-3740493-A1 | Inhibitors of indoleamine 2,3-dioxygenase and/or tryptophan 2,3-dioxygenase | 20180115 |
PMID | Publication Date | Title | Journal |
20710065 | 20100811 | Phenylboronic-acid-based carbohydrate binders as antiviral therapeutics: monophenylboronic acids | Antiviral chemistry & chemotherapy |
Complexity: | 235 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 205.0910234 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 3 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 205.0910234 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 69.6 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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