Dimethyl 4-methoxyisophthalate - CAS 22955-73-3
Catalog: |
BB017839 |
Product Name: |
Dimethyl 4-methoxyisophthalate |
CAS: |
22955-73-3 |
Synonyms: |
dimethyl 4-methoxybenzene-1,3-dicarboxylate |
IUPAC Name: | dimethyl 4-methoxybenzene-1,3-dicarboxylate |
Description: | Dimethyl 4-methoxyisophthalate (CAS# 22955-73-3 ) is a useful research chemical. |
Molecular Weight: | 224.21 |
Molecular Formula: | C11H12O5 |
Canonical SMILES: | COC1=C(C=C(C=C1)C(=O)OC)C(=O)OC |
InChI: | InChI=1S/C11H12O5/c1-14-9-5-4-7(10(12)15-2)6-8(9)11(13)16-3/h4-6H,1-3H3 |
InChI Key: | VYLTWLWJTAJDSS-UHFFFAOYSA-N |
Boiling Point: | 331.6 °C at 760 mmHg |
Density: | 1.184 g/cm3 |
MDL: | MFCD06204071 |
LogP: | 1.26840 |
GHS Hazard Statement: | H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation] |
Precautionary Statement: | P264, P280, P305+P351+P338, and P337+P313 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-112159347-A | Preparation method of picolitamide | 20201027 |
US-6525078-B1 | Compound for the treatment of atherosclerotic-thrombotic pathological conditions | 20020625 |
DE-60128077-T2 | Compound for the treatment of atherosclerotic and thrombotic diseases | 20010621 |
EP-1270558-A1 | "Compound for the treatment of atherosclerotic-thrombotic pathological conditions" | 20010621 |
EP-1270558-B1 | "Compound for the treatment of atherosclerotic-thrombotic pathological conditions" | 20010621 |
Complexity: | 263 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 224.06847348 |
Formal Charge: | 0 |
Heavy Atom Count: | 16 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 224.06847348 |
Rotatable Bond Count: | 5 |
Topological Polar Surface Area: | 61.8 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.9 |
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