- trans-Stilbene
- trans-Stilbene oxide
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Cas Database |
| Name |
trans-Stilbene oxide |
EINECS | 215-877-7 |
| CAS No. | 1439-07-2 | Density | 1.136 g/cm3 |
| PSA | 12.53000 | LogP | 3.49920 |
| Solubility | N/A | Melting Point |
65-67 °C(lit.) |
| Formula | C14H12O | Boiling Point | 304.5 °C at 760 mmHg |
| Molecular Weight | 196.249 | Flash Point | 133.4 °C |
| Transport Information | N/A | Appearance | white to light yellow crystal powder |
| Safety | 22-24/25 | Risk Codes | 36/37/38 |
| Molecular Structure |
|
Hazard Symbols |
 F
|
| Synonyms |
Bibenzyl, a,a'-epoxy-, trans- (8CI);Oxirane, 2,3-diphenyl-,trans-;(2R,3R)-rel-2,3-Diphenyloxirane;(E)-Stilbene epoxide;(?à)-trans-2,3-Diphenyloxirane;(?à)-trans-Stilbene oxide;NSC100317;NSC 40295;rel-(2R,3R)-2,3-Diphenyloxirane;trans-(?à)-2,3-Diphenyloxirane;trans-1,2-Diphenylethylene oxide;trans-2,3-Diphenyloxirane;trans-Diphenyl-1,2-epoxyethane;trans-Stilbene epoxide;trans-Stilbene oxide;trans-a,a'-Epoxybibenzyl; |
Article Data | 895 |
trans-Stilbene oxide Synthetic route
| Conditions | Yield |
|---|---|
| With 3-chloro-benzenecarboperoxoic acid; iron(III) perchlorate In acetonitrile at -10℃; for 0.0833333h; | 100% |
| With sodium periodate; 5-Nitro-1,10-phenanthroline; iron(II) sulfate In dichloromethane; water at 20℃; for 20h; | 100% |
| With (5,10,15,20-tetrakis(p-methoxyphenyl)-21H,23H-porphyrinate)cobalt(II); oxygen; isobutyraldehyde In acetonitrile for 3h; Ambient temperature; | 100% |
| Conditions | Yield |
|---|---|
| With sodium chlorite; edetate disodium In water; acetonitrile at 55 - 65℃; for 14h; | 100% |
| With urea hydrogen peroxide adduct; ruthenium(2,2',6':2''-terpyridine)(2,6-pyridinedicarboxylate) In tert-Amyl alcohol at 20℃; for 1h; Product distribution; Further Variations:; Catalysts; Reagents; | 99% |
| With Oxone; ethylenediaminetetraacetic acid; sodium carbonate In water; acetonitrile at 0 - 20℃; for 6h; | 98% |
- 100-52-7
benzaldehyde
- 119547-76-1
dimethyl<(phenyl)trimethylsilylmehyl>sulfoniumtrifluoromethanesulfonate
- 1439-07-2
trans-Stilbene oxide
| Conditions | Yield |
|---|---|
| With cesium fluoride In 1,2-dimethoxyethane at 45℃; for 18h; | 98% |
| Conditions | Yield |
|---|---|
| With thiophene; N-benzyl-N,N,N-triethylammonium chloride; dirhodium tetraacetate In acetonitrile at 40℃; for 24h; | A n/a B 98% |
| Conditions | Yield |
|---|---|
| With hydrotris(3,4,5-tribromopyrazolyl)borate Cu (NCMe); dimethylsulfide In dichloromethane; toluene at 20℃; for 2h; Catalytic behavior; Reagent/catalyst; Solvent; Inert atmosphere; diastereoselective reaction; | 95% |
| With copper acetylacetonate; ethyl isopropyl sulfide In dichloromethane | 73% |
- 27992-27-4, 40154-38-9
sodium 2-benzylidene-1-tosylhydrazin-1-ide
- 100-52-7
benzaldehyde
- 1439-07-2
trans-Stilbene oxide
| Conditions | Yield |
|---|---|
| With thiophene; dirhodium tetraacetate; N-benzyl-N,N,N-triethylammonium chloride In acetonitrile at 40℃; for 3h; | 95% |
| Conditions | Yield |
|---|---|
| With 1H-imidazole; chloro(meso-tetrakis(2,6-dichlorophenyl)porphyrinato)manganese(III); dihydrogen peroxide In dichloromethane; acetonitrile for 2h; Ambient temperature; | A 94% B 3% |
| With 1H-imidazole; manganese(III) meso-tetraphenylporphyrin acetate; tetrabutylammonium periodite In dichloromethane; tert-butyl alcohol at 22℃; for 5h; Inert atmosphere; | A 92% B 3% |
| With oxygen In water at 25℃; under 760.051 Torr; for 4h; | A n/a B 92% |
- 645-49-8
cis-stilben
A
- 451-40-1
phenyl benzyl ketone
B
- 1689-71-0
cis-1,2-diphenyloxirane
- 1439-07-2
trans-Stilbene oxide
| Conditions | Yield |
|---|---|
| With 1H-imidazole; dihydrogen peroxide; Mn(TDCPP)Cl In dichloromethane; acetonitrile for 0.25h; Ambient temperature; | A 2% B 92% C 2% |
| With tert.-butylhydroperoxide In water; acetonitrile at 85℃; for 24h; Catalytic behavior; | A 7.2 %Chromat. B 42.3% C 8.3% |
| With O(3P) prepared by O2 discharge at 0℃; for 0.5h; | A 29% B 31% C 40% |
| Conditions | Yield |
|---|---|
| With [bis(acetoxy)iodo]benzene; ruthenium(2,2',6':2''-terpyridine)(2,6-pyridinedicarboxylate) In dichloromethane for 72h; Ambient temperature; | A n/a B 92% |
| With oxygen; isobutyraldehyde; 4 In water; 1,2-dichloro-ethane at 40℃; for 72h; | A 15% B 83% |
| With pyridine N-oxide; oxochromium(V) complex of tetramethylsalen IIb In acetonitrile | A 10% B 81% |
| Conditions | Yield |
|---|---|
| With sodium hydrogencarbonate; 3-chloro-benzenecarboperoxoic acid In dichloromethane at 20℃; | 91% |
| With Perbenzoic acid; chloroform | |
| With 3-chloro-benzenecarboperoxoic acid |
trans-Stilbene oxide Specification
The trans-Stilbene oxide, with the CAS registry number 1439-07-2, is also called trans-α,α'-Epoxybibenzyl. It is a kind of white to light yellow crystal powder, and belongs to the following product categories: Chiral; Oxiranes; Simple 3-Membered Ring Compounds. And the molecular formula of the chemical is C14H12O.
The characteristics of this chemical are as followings: (1)ACD/LogP: 3.39; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.39; (4)ACD/LogD (pH 7.4): 3.39; (5)ACD/BCF (pH 5.5): 220.53; (6)ACD/BCF (pH 7.4): 220.53; (7)ACD/KOC (pH 5.5): 1656.03; (8)ACD/KOC (pH 7.4): 1656.03; (9)#H bond acceptors: 1; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 12.53 Å2; (13)Index of Refraction: 1.608; (14)Molar Refractivity: 59.71 cm3; (15)Molar Volume: 172.6 cm3; (16)Polarizability: 23.67×10-24cm3; (17)Surface Tension: 46.7 dyne/cm; (18)Density: 1.136 g/cm3; (19)Flash Point: 133.4 °C; (20)Enthalpy of Vaporization: 52.31 kJ/mol; (21)Boiling Point: 304.5 °C at 760 mmHg; (22)Vapour Pressure: 0.00157 mmHg at 25°C.
You should be cautious while dealing with this chemical. It is a kind of flammable chemical, and irritates to eyes, respiratory system and skin. Therefore, you should not breathe dust and then try to avoid contacting with skin and eyes.
Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: O2C(c1ccccc1)C2c3ccccc3
(2)InChI: InChI=1/C14H12O/c1-3-7-11(8-4-1)13-14(15-13)12-9-5-2-6-10-12/h1-10,13-14H
(3)InChIKey: ARCJQKUWGAZPFX-UHFFFAOYAV
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