1-(2-Hydroxyphenyl)-2-phenylethanone - CAS 2491-31-8
Catalog: |
BB076921 |
Product Name: |
1-(2-Hydroxyphenyl)-2-phenylethanone |
CAS: |
2491-31-8 |
Synonyms: |
2-Hydroxydeoxybenzoin; 1-(2-Hydroxyphenyl)-2-phenylethan-1-one; Acetophenone, 2'-hydroxy-2-phenyl-; Ethanone, 1-(2-hydroxyphenyl)-2-phenyl-; 2'-Hydroxy-2-phenylacetophenone; Benzyl 2-hydroxyphenyl ketone; Benzyl o-hydroxyphenyl ketone; 2-Hydroxyphenyl benzyl ketone |
IUPAC Name: | 1-(2-hydroxyphenyl)-2-phenylethanone |
Molecular Weight: | 212.24 |
Molecular Formula: | C14H12O2 |
Canonical SMILES: | C1=CC=C(C=C1)CC(=O)C2=CC=CC=C2O |
InChI: | InChI=1S/C14H12O2/c15-13-9-5-4-8-12(13)14(16)10-11-6-2-1-3-7-11/h1-9,15H,10H2 |
InChI Key: | VGHVJQXWDXRTRJ-UHFFFAOYSA-N |
Boiling Point: | 350.1±17.0°C at 760 mmHg |
Melting Point: | 55.0-59.0°C |
Purity: | ≥95% |
Density: | 1.2±0.1 g/cm3 |
Appearance: | Light Yellow to Amber to Dark Green Powder to Crystal |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]; H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation] |
Precautionary Statement: | P264, P264+P265, P280, P302+P352, P305+P351+P338, P321, P332+P317, P337+P317, and P362+P364 |
Signal Word: | Warning |
Complexity: | 231 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 212.083729621 |
Formal Charge: | 0 |
Heavy Atom Count: | 16 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 212.083729621 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 37.3 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.7 |
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