Ethyl 4-hydroxy-6-methyl-2-oxo-3-cyclohexene-1-carboxylate - CAS 67174-68-9
Catalog: |
BB033207 |
Product Name: |
Ethyl 4-hydroxy-6-methyl-2-oxo-3-cyclohexene-1-carboxylate |
CAS: |
67174-68-9 |
Synonyms: |
ethyl 2-hydroxy-6-methyl-4-oxocyclohex-2-ene-1-carboxylate |
IUPAC Name: | ethyl 2-hydroxy-6-methyl-4-oxocyclohex-2-ene-1-carboxylate |
Description: | Ethyl 4-hydroxy-6-methyl-2-oxo-3-cyclohexene-1-carboxylate (CAS# 67174-68-9 ) is a useful research chemical. |
Molecular Weight: | 198.22 |
Molecular Formula: | C10H14O4 |
Canonical SMILES: | CCOC(=O)C1C(CC(=O)C=C1O)C |
InChI: | InChI=1S/C10H14O4/c1-3-14-10(13)9-6(2)4-7(11)5-8(9)12/h5-6,9,12H,3-4H2,1-2H3 |
InChI Key: | IKNXYQZPKRVKHN-UHFFFAOYSA-N |
Appearance: | White to off-white solid |
MDL: | MFCD00010807 |
LogP: | 1.21650 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
US-2010204321-A1 | Antitussive and Bronchodilator uses for enaminone ester | 20060118 |
EP-1905756-A1 | Silver beta-ketocarboxylate, material comprising the same for forming silver metal, and use thereof | 20050704 |
EP-1905756-B1 | Silver beta-ketocarboxylate derivatives for forming silver metal | 20050704 |
US-5663029-A | Electrostatic imaging process | 19960124 |
CA-2169980-C | Method for obtaining improved image contrast in migration imaging members | 19950515 |
Complexity: | 280 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 198.08920892 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 198.08920892 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 63.6 Å2 |
Undefined Atom Stereocenter Count: | 2 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.2 |
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