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2-[([1,1′-Biphenyl]-2-Yloxy)Methyl]Oxirane
CAS: 7144-65-2 | C15H14O2
2D Structure
3D Structure
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Basic Information
CAS Registry Number:
7144-65-2
Molecular Formula:
C15H14O2
Molecular Mass:
226.27 g/mol
Names and Synonyms:
2-[([1,1′-Biphenyl]-2-Yloxy)Methyl]Oxirane
Oxirane, 2-[([1,1′-biphenyl]-2-yloxy)methyl]-
Propane, 1-(2-biphenylyloxy)-2,3-epoxy-
Oxirane, [([1,1′-biphenyl]-2-yloxy)methyl]-
Propane, 3-[2-biphenylyloxy]-1,2-epoxy-
2-[([1,1′-Biphenyl]-2-yloxy)methyl]oxirane
2-(2,3-Epoxypropoxy)biphenyl
3-(2-Xenyloxy)propylene oxide
3-(2-Biphenylyloxy)propylene oxide
3-(2-Xenyloxy)-1,2-epoxypropane
2-Biphenylyl glycidyl ether
OPP-G
Glycidyl o-phenylphenol ether
o-Phenylphenyl glycidyl ether
3-(Biphenyl-2-oxy)-1,2-epoxypropane
NSC 52971
Glycidyl 2-phenylphenyl ether
G 0098
SY-OPG
Denacol EX 142
EX 142
2-(2-Phenylphenoxymethyl)oxirane
Identifiers:
SMILES:
c1ccc(-c2ccccc2OCC2CO2)cc1
InChI:
InChI=1S/C15H14O2/c1-2-6-12(7-3-1)14-8-4-5-9-15(14)17-11-13-10-16-13/h1-9,13H,10-11H2
Key Properties
Boiling Point
132 °C @ Press: 0.1 Torr
CAS Common Chemistry
Spectral Data
NMR, IR, and Mass spectral data
1H NMR
13C NMR
Predicting NMR spectra...
10 ppm
9
8
7
6
5
4
3
2
1
0 ppm
| Shift (ppm) | Multiplicity | Integration | Assignment |
|---|
200 ppm
180
160
140
120
100
80
60
40
20
0 ppm
| Shift (ppm) | DEPT | Assignment |
|---|
Note: These NMR spectra are predicted computationally and may differ from experimental data. Predictions are based on chemical environment analysis.
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 226.27 g/mol | CAS Common Chemistry |
| 226.27499999999995 g/mol | RDKit | |
| 226.099379688 g/mol | RDKit | |
| Boiling Point | 132 °C @ Press: 0.1 Torr | CAS Common Chemistry |
| Canonical SMILES | O(C=1C=CC=CC1C=2C=CC=CC2)CC3OC3 | CAS Common Chemistry |
| InChI | InChI=1S/C15H14O2/c1-2-6-12(7-3-1)14-8-4-5-9-15(14)17-11-13-10-16-13/h1-9,13H,10-11H2 | CAS Common Chemistry |
| InChI Key | InChIKey=DNVXWIINBUTFEP-UHFFFAOYSA-N | CAS Common Chemistry |
| Name | 2-[([1,1′-Biphenyl]-2-yloxy)methyl]oxirane | CAS Common Chemistry |
| Heavy Atom Count | 17 | RDKit |
| Hydrogen Bond Acceptors | 2 | RDKit |
| Hydrogen Bond Donors | 0 | RDKit |
| Rotatable Bonds | 4 | RDKit |
| Aromatic Ring Count | 2 | RDKit |
| Topological Polar Surface Area | 21.759999999999998 Ų | RDKit |
| LogP | 3.1312000000000015 | RDKit |
| Molar Refractivity | 67.11300000000004 | RDKit |