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CAS No.: | 7501-02-2 |
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Name: | 2-(2-BIPHENYLYLOXY)ETHANOL |
Article Data: | 5 |
Molecular Structure: | |
Formula: | C14H14O2 |
Molecular Weight: | 214.264 |
Synonyms: | 2-(2-phenylphenoxy)ethanol;beta-Hydroxyethyl ether of o-phenylphenol;Ethanol, 2- ([1,1-biphenyl]-2-yloxy)-;.beta.-Hydroxyethyl ether of o-phenylphenol;4-06-00-04581 (Beilstein Handbook Reference);Ethyl alcohol, 2-(o-biphenylyloxy)-;Ethanol, 2-((1,1-biphenyl)-2-yloxy)- (9CI);Ethanol,2-([1,1'-biphenyl]-2-yloxy)-;Ethyl alcohol, 2-(o-phenyl)phenoxy-;Ethanol, 2-(2-biphenylyloxy)-; |
EINECS: | 231-355-1 |
Density: | 1.111 g/cm3 |
Boiling Point: | 344.6 °C at 760 mmHg |
Flash Point: | 151.4 °C |
PSA: | 29.46000 |
LogP: | 2.72470 |
Conditions | Yield |
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With potassium carbonate at 160℃; for 1h; Temperature; Reagent/catalyst; | 99.2% |
ethyl (<1,1'-biphenyl>-2-yloxy)acetate
2-(<1,1'-biphenyl>2-yloxy)ethanol
Conditions | Yield |
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With lithium aluminium tetrahydride In tetrahydrofuran at 0℃; for 1h; | 95% |
With lithium aluminium tetrahydride In tetrahydrofuran at 0℃; for 1h; |
Conditions | Yield |
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With potassium hydroxide |
Conditions | Yield |
---|---|
Multi-step reaction with 2 steps 1: K2CO3 / dimethylformamide / 4 h 2: LiAlH4 / tetrahydrofuran / 1 h / 0 °C View Scheme |
Conditions | Yield |
---|---|
Multi-step reaction with 2 steps 1: 1.) NaH / 1.) DMF, 0 deg C, 2.) DMF, RT, overnight 2: 95 percent / lithium aluminium hydride / tetrahydrofuran / 1 h / 0 °C View Scheme |
Conditions | Yield |
---|---|
With methanesulfonic acid; 3-mercaptopropionic acid In toluene at 50 - 80℃; for 5.5h; Time; Reagent/catalyst; Inert atmosphere; | 90% |
With 3-mercaptopropionic acid In 5,5-dimethyl-1,3-cyclohexadiene at 60℃; for 6h; Solvent; | 87% |
With sulfuric acid; 3-mercaptopropionic acid In 5,5-dimethyl-1,3-cyclohexadiene at 60 - 95℃; for 64h; |
Conditions | Yield |
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With sodium; xylene |
Conditions | Yield |
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With benzenesulfonic acid; benzene at 90 - 120℃; |
2-(<1,1'-biphenyl>2-yloxy)ethanol
o-carboxybenzaldehyde
3-(2-biphenyl-2-yloxy-ethoxy)-phthalide
Conditions | Yield |
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With triethylamine In tetrahydrofuran for 1h; Ambient temperature; |
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The Ethanol, 2-(o-biphenylyloxy)-, with the CAS registry number 7501-02-2, is also known as Ethanol, 2-((1,1'-biphenyl)-2-yloxy)- (9CI). Its EINECS registry number is 231-355-1. This chemical's molecular formula is C14H14O2 and molecular weight is 214.26. Its IUPAC name is called 2-(2-phenylphenoxy)ethanol. The product should be sealed and stored in cool, dry place.
Physical properties of Ethanol, 2-(o-biphenylyloxy)-: (1)ACD/LogP: 2.67; (2)ACD/LogD (pH 5.5): 2.67; (3)ACD/LogD (pH 7.4): 2.67; (4)ACD/BCF (pH 5.5): 62.59; (5)ACD/BCF (pH 7.4): 62.59; (6)ACD/KOC (pH 5.5): 672.26; (7)ACD/KOC (pH 7.4): 672.26; (8)#H bond acceptors: 2; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 5; (11)Index of Refraction: 1.575; (12)Molar Refractivity: 63.69 cm3; (13)Molar Volume: 192.7 cm3; (14)Surface Tension: 43 dyne/cm; (15)Density: 1.111 g/cm3; (16)Flash Point: 151.4 °C; (17)Enthalpy of Vaporization: 62.12 kJ/mol; (18)Boiling Point: 344.6 °C at 760 mmHg; (19)Vapour Pressure: 2.47E-05 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)Canonical SMILES: C1=CC=C(C=C1)C2=CC=CC=C2OCCO
(2)InChI: InChI=1S/C14H14O2/c15-10-11-16-14-9-5-4-8-13(14)12-6-2-1-3-7-12/h1-9,15H,10-11H2
(3)InChIKey: NOZAKUWNUGNDLI-UHFFFAOYSA-N
The toxicity data is as follows:
Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
---|---|---|---|---|---|
mouse | LD50 | intraperitoneal | 75mg/kg (75mg/kg) | National Technical Information Service. Vol. AD691-490, |