3-Methoxy-5-(methoxycarbonyl)benzoic Acid - CAS 71590-08-4
Catalog: |
BB034427 |
Product Name: |
3-Methoxy-5-(methoxycarbonyl)benzoic Acid |
CAS: |
71590-08-4 |
Synonyms: |
3-methoxy-5-methoxycarbonylbenzoic acid; 3-methoxy-5-methoxycarbonylbenzoic acid |
IUPAC Name: | 3-methoxy-5-methoxycarbonylbenzoic acid |
Description: | 3-Methoxy-5-(methoxycarbonyl)benzoic Acid (CAS# 71590-08-4) is a useful research chemical. |
Molecular Weight: | 210.18 |
Molecular Formula: | C10H10O5 |
Canonical SMILES: | COC1=CC(=CC(=C1)C(=O)OC)C(=O)O |
InChI: | InChI=1S/C10H10O5/c1-14-8-4-6(9(11)12)3-7(5-8)10(13)15-2/h3-5H,1-2H3,(H,11,12) |
InChI Key: | PMYOJVWSJTZGDJ-UHFFFAOYSA-N |
Boiling Point: | 383.4 ℃ at 760 mmHg |
Density: | 1.282 g/cm3 |
LogP: | 1.18000 |
Publication Number | Title | Priority Date |
WO-2012019428-A1 | Benzohydrol derivatives, a preparation process and pharmaceutical use thereof | 20100810 |
US-2013053407-A1 | Pyrrolo [3,2-d] pyrimidin-3-yl derivatives used as activators of ampk | 20100505 |
JP-2013047189-A | Novel paravanic acid derivatives and pharmaceuticals containing them as active ingredients | 20091225 |
WO-2011078370-A1 | Novel parabanic acid derivative and drug having the same as active ingredient | 20091225 |
EP-2490766-A1 | Non-natural macrocyclic amide hdac6 inhibitor compounds and their uses as therapeutic agents | 20091021 |
Complexity: | 250 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 210.05282342 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 210.05282342 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 72.8 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.8 |
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