Methyl 2,6-dihydroxybenzoate - CAS 2150-45-0
Catalog: |
BB016922 |
Product Name: |
Methyl 2,6-dihydroxybenzoate |
CAS: |
2150-45-0 |
Synonyms: |
methyl 2,6-dihydroxybenzoate |
Application: |
methyl 2,6-dihydroxybenzoate (cas# 2150-45-0) is a useful research chemical. |
IUPAC Name: | methyl 2,6-dihydroxybenzoate |
Description: | Methyl 2,6-dihydroxybenzoate is a natural compound isolated from the herbs of Uvaria purpurea. |
Molecular Weight: | 168.15 |
Molecular Formula: | C8H8O4 |
Canonical SMILES: | COC(=O)C1=C(C=CC=C1O)O |
InChI: | InChI=1S/C8H8O4/c1-12-8(11)7-5(9)3-2-4-6(7)10/h2-4,9-10H,1H3 |
InChI Key: | WCQZCKUNZVMBDC-UHFFFAOYSA-N |
Boiling Point: | 253.6 °C at 760 mmHg |
Density: | 1.354 g/cm3 |
Appearance: | Powder |
MDL: | MFCD00059619 |
LogP: | 0.88440 |
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 |
JP-2020169243-A | Anionic epoxy resin or a salt thereof, an emulsion, a surface treatment agent, a material having a film, and a method for producing the same. | 20190402 |
WO-2020099953-A1 | Composition and method for preventing or reducing low speed pre-ignition in spark-ignited internal combustion engines | 20181115 |
US-2021171883-A1 | Antiviral wiper | 20180829 |
CN-108558777-B | Pyrimidine salicylic acid derivative and preparation method and application thereof | 20180731 |
WO-2019235526-A1 | Rubber composition and tire | 20180606 |
PMID | Publication Date | Title | Journal |
21588066 | 20100630 | Methyl 2,6-bis-[(5-chloro-4,6-dimeth-oxy-pyrimidin-2-yl)-oxy]benzoate | Acta crystallographica. Section E, Structure reports online |
21588067 | 20100630 | Methyl 2,6-bis-[(5-bromo-4,6-dimeth-oxy-pyrimidin-2-yl)-oxy]benzoate | Acta crystallographica. Section E, Structure reports online |
Complexity: | 158 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 168.04225873 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 168.04225873 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 66.8 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2 |
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