4-(Hydroxymethyl)phenylboronic acid - CAS 59016-93-2
Catalog: |
BB030235 |
Product Name: |
4-(Hydroxymethyl)phenylboronic acid |
CAS: |
59016-93-2 |
Synonyms: |
4-(Hydroxymethyl)benzeneboronic Acid; 4-hydroxymethylphenylboronic acid; p-(hydroxymethyl)phenylboronic acid; PubChem1726; ACMC-1AY7A; AMTB316; hydroxymethylphenylboronic acid; KSC269G5N; Boronic acid, B-[4-(hydroxymethyl)phenyl]- |
IUPAC Name: | [4-(hydroxymethyl)phenyl]boronic acid |
Description: | 4-(Hydroxymethyl) phenylboronic acid was involved in the synthesis of bioactive compounds as reactants. |
Molecular Weight: | 151.96 |
Molecular Formula: | C7H9BO3 |
Canonical SMILES: | B(C1=CC=C(C=C1)CO)(O)O |
InChI: | InChI=1S/C7H9BO3/c9-5-6-1-3-7(4-2-6)8(10)11/h1-4,9-11H,5H2 |
InChI Key: | PZRPBPMLSSNFOM-UHFFFAOYSA-N |
Boiling Point: | 362.0±44.0 °C (Predicted) |
Melting Point: | 251-256 °C |
Flash Point: | Not applicable |
Purity: | > 98 % (HPLC) |
Density: | 1.250±0.10 g/cm3 (Predicted) |
Solubility: | Soluble in Water (25 g/L) |
Appearance: | Grayish-white crystals |
Storage: | 2-8 °C |
MDL: | MFCD00792672 |
LogP: | -1.14130 |
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 |
CN-113354675-A | Preparation method of 4-hydroxymethyl phenylboronic acid | 20210701 |
CN-113214303-A | Nitrogen mustard anti-tumor functional molecule, preparation method and application thereof | 20210425 |
CN-112656952-A | Nano medicine and its preparing method and use | 20201225 |
CN-112625257-A | Preparation method of MOF-Cu and application of MOF-Cu in synthesis of diaryl sulfone compounds | 20201211 |
CN-112390751-A | Toll-like receptor-7 small molecule inhibitor and preparation method thereof | 20201105 |
Complexity: | 110 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 152.0644743 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 3 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 152.0644743 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 60.7 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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