2,3-Dihydrobenzofuran-2-carboxylic Acid - CAS 1914-60-9
Catalog: |
BB014814 |
Product Name: |
2,3-Dihydrobenzofuran-2-carboxylic Acid |
CAS: |
1914-60-9 |
Synonyms: |
2,3-dihydrobenzofuran-2-carboxylic acid; 2,3-dihydro-1-benzofuran-2-carboxylic acid |
IUPAC Name: | 2,3-dihydro-1-benzofuran-2-carboxylic acid |
Description: | 2,3-Dihydrobenzofuran-2-carboxylic Acid (CAS# 1914-60-9) is the starting material in the synthesis of (dihydro)benzofuran-2-carboxylic acid N-(substituted)phenylamide derivatives as anticancer agents. |
Molecular Weight: | 164.16 |
Molecular Formula: | C9H8O3 |
Canonical SMILES: | C1C(OC2=CC=CC=C21)C(=O)O |
InChI: | InChI=1S/C9H8O3/c10-9(11)8-5-6-3-1-2-4-7(6)12-8/h1-4,8H,5H2,(H,10,11) |
InChI Key: | WEVFUSSJCGAVOH-UHFFFAOYSA-N |
Boiling Point: | 340.5 °C at 760 mmHg |
Density: | 1.347 g/cm3 |
MDL: | MFCD03086168 |
LogP: | 1.07470 |
GHS Hazard Statement: | H302 (25%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P273, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P391, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
WO-2020244460-A1 | Heteroaromatic acetamide derivative, and preparation and use thereof | 20190603 |
WO-2020223536-A1 | Substituted cyclolakyls as modulators of the integrated stress pathway | 20190430 |
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US-2020241414-A1 | Resist composition and patterning process | 20190129 |
WO-2020140050-A1 | N-(4-(oxazol-5-yl)phenyl)chromane-3-carboxamide derivatives and related compounds as stimulators of the production of retinal precursor cells for the treatment of neuroretinal diseases | 20181228 |
Complexity: | 190 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 164.047344113 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 164.047344113 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 46.5 Å2 |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.5 |
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