trans-4-(2-Ethoxy-2-oxoethyl)cyclohexanecarboxylic Acid - CAS 880104-40-5
Catalog: |
BB038715 |
Product Name: |
trans-4-(2-Ethoxy-2-oxoethyl)cyclohexanecarboxylic Acid |
CAS: |
880104-40-5 |
Synonyms: |
4-(2-ethoxy-2-oxoethyl)-1-cyclohexanecarboxylic acid; 4-(2-ethoxy-2-oxoethyl)cyclohexane-1-carboxylic acid |
IUPAC Name: | 4-(2-ethoxy-2-oxoethyl)cyclohexane-1-carboxylic acid |
Description: | trans-4-(2-Ethoxy-2-oxoethyl)cyclohexanecarboxylic Acid (CAS# 880104-40-5 ) is a useful research chemical. |
Molecular Weight: | 214.26 |
Molecular Formula: | C11H18O4 |
Canonical SMILES: | CCOC(=O)CC1CCC(CC1)C(=O)O |
InChI: | InChI=1S/C11H18O4/c1-2-15-10(12)7-8-3-5-9(6-4-8)11(13)14/h8-9H,2-7H2,1H3,(H,13,14) |
InChI Key: | MHKFPZVBEMBDHC-UHFFFAOYSA-N |
Publication Number | Title | Priority Date |
CN-113056264-A | Farnesoin X receptor agonists and uses thereof | 20180918 |
AU-2018291688-A1 | Heteroaryldihydropyrimidine derivatives and methods of treating hepatitis B infections | 20170627 |
CA-3066857-A1 | Heteroaryldihydropyrimidine derivatives and methods of treating hepatitis b infections | 20170627 |
CN-110809574-A | Heteroaryl dihydropyrimidine derivatives and methods for treating hepatitis b infection | 20170627 |
EP-3645516-A1 | Heteroaryldihydropyrimidine derivatives and methods of treating hepatitis b infections | 20170627 |
Complexity: | 229 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 214.12050905 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 214.12050905 |
Rotatable Bond Count: | 5 |
Topological Polar Surface Area: | 63.6 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.8 |
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