1-Hydroxycyclohexyl Phenyl Ketone - CAS 947-19-3
Catalog: |
BB041469 |
Product Name: |
1-Hydroxycyclohexyl Phenyl Ketone |
CAS: |
947-19-3 |
Synonyms: |
(1-hydroxycyclohexyl)-phenylmethanone; (1-hydroxycyclohexyl)-phenylmethanone |
Application: |
This product is suitable for scientific research. |
IUPAC Name: | (1-hydroxycyclohexyl)-phenylmethanone |
Description: | 4'-Hydroxyacetophenone has been used as ketone component in the preparation of 1-aryl-3-phenethylamino-1-propanone hydrochlorides, potential cytotoxic agents, via Mannich reactions. |
Molecular Weight: | 204.26 |
Molecular Formula: | C13H16O2 |
Canonical SMILES: | C1CCC(CC1)(C(=O)C2=CC=CC=C2)O |
InChI: | InChI=1S/C13H16O2/c14-12(11-7-3-1-4-8-11)13(15)9-5-2-6-10-13/h1,3-4,7-8,15H,2,5-6,9-10H2 |
InChI Key: | QNODIIQQMGDSEF-UHFFFAOYSA-N |
Boiling Point: | 175 °C (15 mmHg) |
Melting Point: | 47-50 °C |
Flash Point: | 164 °C |
Purity: | 98 % |
Density: | 1.17 g/cm3 |
Appearance: | White crystalline powder |
Storage: | Inert atmosphere, Room Temperature |
MDL: | MFCD00059561 |
LogP: | 2.56450 |
Quality Standard: | 200 |
Refractive Index: | n20/D 1.475 (lit.) |
Precautionary Statement: | P264: Wash thoroughly after handling. P280: Wear protective gloves/protective clothing/eye protection/face protection. P302+P352: IF ON SKIN: Wash with plenty of soap and water. P332+P313: If skin irritation occurs: Get medical advice/attention. P337+P313: If eye irritation persists: Get medical advice/attention. P362+P364: Take off contaminated clothing. [As modified by IV ATP]. And wash it before reuse. [Added by IV ATP]. |
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PMID | Publication Date | Title | Journal |
23037171 | 20120101 | Quantitation and human monocyte cytotoxicity of the polymerization agent 1-hydroxycyclohexyl phenyl ketone (Irgacure 184) from three brands of aqueous injection solution | Biological & pharmaceutical bulletin |
21847975 | 20110501 | [Determination of photoinitiators in printing inks used in food contact materials] | Se pu = Chinese journal of chromatography |
19784638 | 20091201 | Determination of low-level ink photoinitiator residues in packaged milk by solid-phase extraction and LC-ESI/MS/MS using triple-quadrupole mass analyzer | Analytical and bioanalytical chemistry |
19807101 | 20091028 | Study of the migration of photoinitiators used in printed food-packaging materials into food simulants | Journal of agricultural and food chemistry |
19412283 | 20090501 | Process equipped with a sloped UV lamp for the fabrication of gradient-refractive-index lenses | Optics letters |
Complexity: | 223 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 204.115029749 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 204.115029749 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 37.3 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.6 |
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