2,6-Dihydroxybenzoic acid - CAS 303-07-1
Catalog: |
BB020541 |
Product Name: |
2,6-Dihydroxybenzoic acid |
CAS: |
303-07-1 |
Synonyms: |
2,6-dihydroxybenzoic acid |
IUPAC Name: | 2,6-dihydroxybenzoic acid |
Description: | 2,6-Dihydroxybenzoic acid (CAS# 303-07-1) is used in biological studies to evaluate the microbial metabolism of various sources of polyphenols in colon area. |
Molecular Weight: | 154.12 |
Molecular Formula: | C7H6O4 |
Canonical SMILES: | C1=CC(=C(C(=C1)O)C(=O)O)O |
InChI: | InChI=1S/C7H6O4/c8-4-2-1-3-5(9)6(4)7(10)11/h1-3,8-9H,(H,10,11) |
InChI Key: | AKEUNCKRJATALU-UHFFFAOYSA-N |
Boiling Point: | 343.7 °C at 760 mmHg |
Melting Point: | 154-155 °C |
Purity: | 95 % |
Density: | 1.559 g/cm3 |
Solubility: | 9.56 mg/mL |
Appearance: | White to yellow powder |
MDL: | MFCD00002462 |
LogP: | 0.79600 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]; H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]; H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract 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 |
US-11072694-B1 | Biobased compositions | 20210216 |
CN-112979866-A | Polymer, saccharide monolithic column and preparation method and application thereof | 20210208 |
US-10934384-B1 | Polyurethane elastomer compositions, and processes thereof | 20200909 |
US-10934385-B1 | Polyurethane elastomers, bio-additive foam compositions | 20200909 |
CN-111925702-A | Photocurable coating containing hyperbranched polyester ether type photocureable resin and preparation method thereof | 20200825 |
PMID | Publication Date | Title | Journal |
24060682 | 20131125 | Differentiation between stoichiometric and anticatalytic antioxidant properties of benzoic acid analogues: a structure/redox potential relationship study | Chemico-biological interactions |
22988610 | 20120701 | Fate and effect of xenobiotics on biodegradation processes: basis for respirometric appraisal | Environmental technology |
21612806 | 20110801 | Phenolic compounds from the cultured mycobionts of Graphis proserpens | Phytochemistry |
21754602 | 20110601 | Tetra-aqua-bis-(2,6-dihy-droxy-benzoato-κO)(2,6-dihy-droxy-benzoato-κO,O)gadolinium(III) dihydrate | Acta crystallographica. Section E, Structure reports online |
21189019 | 20110127 | Identifying chelators for metalloprotein inhibitors using a fragment-based approach | Journal of medicinal chemistry |
Complexity: | 147 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 154.02660867 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 3 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 154.02660867 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 77.8 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.2 |
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