269980
3-Phenoxyphenol
98%
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About This Item
Linear Formula:
C6H5OC6H4OH
CAS Number:
Molecular Weight:
186.21
NACRES:
NA.22
PubChem Substance ID:
UNSPSC Code:
12352100
EC Number:
211-930-3
MDL number:
Assay:
98%
assay
98%
refractive index
n20/D 1.601 (lit.)
bp
185 °C/12 mmHg (lit.)
mp
41-42 °C (lit.)
density
1.159 g/mL at 25 °C (lit.)
SMILES string
Oc1cccc(Oc2ccccc2)c1
InChI
1S/C12H10O2/c13-10-5-4-8-12(9-10)14-11-6-2-1-3-7-11/h1-9,13H
InChI key
HBUCPZGYBSEEHF-UHFFFAOYSA-N
General description
The thermodynamic properties of 3-phenoxyphenol was studied using a combination of effusion and calorimetric techniques and also by high-level ab initio molecular orbital calculations. The standard molar enthalpy of formation of 3-phenoxyphenol was determined using Calvet microcalorimetry.
signalword
Warning
hcodes
Hazard Classifications
Acute Tox. 4 Oral - Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3
target_organs
Respiratory system
Storage Class
10 - Combustible liquids
wgk
WGK 3
flash_point_f
235.4 °F - closed cup
flash_point_c
113 °C - closed cup
ppe
Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter
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Manuel A V Ribeiro da Silva et al.
The Journal of organic chemistry, 76(10), 3754-3764 (2011-04-14)
Thermodynamic properties of 3- and 4-phenoxyphenol have been determined by using a combination of calorimetric and effusion techniques as well as by high-level ab initio molecular orbital calculations. The standard (p° = 0.1 MPa) molar enthalpies of formation in the
Global Trade Item Number
| SKU | GTIN |
|---|---|
| 269980-5G | 04061837007491 |