3-Chloro-4-hydroxy-5-methoxybenzaldehyde - CAS 19463-48-0
Catalog: |
BB015070 |
Product Name: |
3-Chloro-4-hydroxy-5-methoxybenzaldehyde |
CAS: |
19463-48-0 |
Synonyms: |
3-chloro-4-hydroxy-5-methoxybenzaldehyde |
IUPAC Name: | 3-chloro-4-hydroxy-5-methoxybenzaldehyde |
Description: | 3-Chloro-4-hydroxy-5-methoxybenzaldehyde (CAS# 19463-48-0) is a useful research chemical. |
Molecular Weight: | 186.59 |
Molecular Formula: | C8H7ClO3 |
Canonical SMILES: | COC1=C(C(=CC(=C1)C=O)Cl)O |
InChI: | InChI=1S/C8H7ClO3/c1-12-7-3-5(4-10)2-6(9)8(7)11/h2-4,11H,1H3 |
InChI Key: | ONIVKFDMLVBDRK-UHFFFAOYSA-N |
Boiling Point: | 288.1 °C at 760 mmHg |
Density: | 1.377 g/cm3 |
MDL: | MFCD00016982 |
LogP: | 1.86670 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P273, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
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PMID | Publication Date | Title | Journal |
33823243 | 20210601 | Vanillin exerts therapeutic effects against hyperglycemia-altered glucose metabolism and purinergic activities in testicular tissues of diabetic rats | Reproductive toxicology (Elmsford, N.Y.) |
29216766 | 20180901 | Vanillin mitigates the adverse impact of cisplatin and methotrexate on rat kidneys | Human & experimental toxicology |
29222099 | 20180215 | Isolation of the (+)-Pinoresinol-Mineralizing Pseudomonas sp. Strain SG-MS2 and Elucidation of Its Catabolic Pathway | Applied and environmental microbiology |
26296324 | 20161201 | Altered hepatic mRNA expression of immune response-associated DNA damage in mice liver induced by potassium bromate: Protective role of vanillin | Environmental toxicology |
27074584 | 20160525 | Vanillin mitigates potassium bromate-induced molecular, biochemical and histopathological changes in the kidney of adult mice | Chemico-biological interactions |
Complexity: | 162 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 186.0083718 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 186.0083718 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 46.5 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.6 |
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