3-Hydroxy-4-iodobenzoic acid - CAS 58123-77-6
Catalog: |
BB029941 |
Product Name: |
3-Hydroxy-4-iodobenzoic acid |
CAS: |
58123-77-6 |
Synonyms: |
3-hydroxy-4-iodobenzoic acid |
IUPAC Name: | 3-hydroxy-4-iodobenzoic acid |
Description: | 3-Hydroxy-4-iodobenzoic acid (CAS# 58123-77-6) is a useful research chemical. |
Molecular Weight: | 264.02 |
Molecular Formula: | C7H5IO3 |
Canonical SMILES: | C1=CC(=C(C=C1C(=O)O)O)I |
InChI: | InChI=1S/C7H5IO3/c8-5-2-1-4(7(10)11)3-6(5)9/h1-3,9H,(H,10,11) |
InChI Key: | UABBBWVTEWIIMN-UHFFFAOYSA-N |
Boiling Point: | 319.8 ℃ at 760 mmHg |
Melting Point: | 227-229 ℃ |
Purity: | 98 % |
Density: | 2.155 g/cm3 |
MDL: | MFCD02068386 |
LogP: | 1.69500 |
GHS Hazard Statement: | H301 (86.96%): Toxic if swallowed [Danger Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P310, P302+P352, P304+P340, P305+P351+P338, P310, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
CN-112625057-A | Synthetic method of methyl 3-hydroxy-4- ((trimethylsilyl) ethynyl) benzoate | 20201225 |
WO-2021198283-A1 | Inhibitors of antigen presentation by hla-dr | 20200331 |
CN-112939948-A | Novel quinazoline-containing compound, intermediate and application thereof | 20191211 |
WO-2021115432-A1 | Novel quinazoline-containing compound, and intermediate thereof and use thereof | 20191211 |
WO-2020264490-A1 | Irak degraders and uses thereof | 20190628 |
Complexity: | 160 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 263.92834 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 263.92834 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 57.5 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.7 |
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