1-(3,4-Dimethoxyphenyl)cyclopropanecarboxylic Acid - CAS 862821-16-7
Catalog: |
BB037881 |
Product Name: |
1-(3,4-Dimethoxyphenyl)cyclopropanecarboxylic Acid |
CAS: |
862821-16-7 |
Synonyms: |
1-(3,4-dimethoxyphenyl)-1-cyclopropanecarboxylic acid; 1-(3,4-dimethoxyphenyl)cyclopropane-1-carboxylic acid |
IUPAC Name: | 1-(3,4-dimethoxyphenyl)cyclopropane-1-carboxylic acid |
Description: | 1-(3,4-Dimethoxyphenyl)cyclopropanecarboxylic Acid (CAS# 862821-16-7) is a useful research chemical. |
Molecular Weight: | 222.24 |
Molecular Formula: | C12H14O4 |
Canonical SMILES: | COC1=C(C=C(C=C1)C2(CC2)C(=O)O)OC |
InChI: | InChI=1S/C12H14O4/c1-15-9-4-3-8(7-10(9)16-2)12(5-6-12)11(13)14/h3-4,7H,5-6H2,1-2H3,(H,13,14) |
InChI Key: | FELRPROQUKLRFC-UHFFFAOYSA-N |
Boiling Point: | 376.412 °C at 760 mmHg |
Density: | 1.262 g/cm3 |
Appearance: | Solid |
LogP: | 1.82000 |
Publication Number | Title | Priority Date |
KR-102230832-B1 | N-substituted thiourea or urea derivatives and pharmaceutical composition for use in preventing or treating glutaminyl cyclase activity related diseases containing the same as an active ingredient | 20190617 |
KR-20200144180-A | N-substituted thiourea or urea derivatives and pharmaceutical composition for use in preventing or treating glutaminyl cyclase activity related diseases containing the same as an active ingredient | 20190617 |
US-2011098311-A1 | Compositions for treatment of cystic fibrosis and other chronic diseases | 20091022 |
US-2014121208-A1 | Compositions for Treatment of Cystic Fibrosis and Other Chronic Diseases | 20091022 |
US-2014329814-A2 | Compositions for Treatment of Cystic Fibrosis and Other Chronic Diseases | 20091022 |
Complexity: | 272 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 222.08920892 |
Formal Charge: | 0 |
Heavy Atom Count: | 16 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 222.08920892 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 55.8 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.7 |
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