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2-Phenylphenol

Properties, data and information sources.

 

Contents

o-Phenylphenol is an organic chemical compound from the group of biphenyl derivatives (monohydroxylated derivative).

 

Names and Identifiers

Name
2-Phenylphenol
Formula
C12H10O
Molar mass
170.211 (g/mol)
CAS registry number
90-43-7
EC number EINECS
201-993-5
InChI Key
LLEMOWNGBBNAJR-UHFFFAOYSA-N

Systematic name
[1,1´-Biphenyl]-2-ol

Other names, synonyms
Biphenyl-2-ol; Orthophenyl phenol

Abbreviation
OPP

INCI name
O-PHENYLPHENOL

Trade names; preparations
Dowicide; Torsite; Fungal; Preventol; Nipacide; Manusept; NECTRYL; Nipacide OPP; o-Xonal; Remol TRF; Stellisept; Tetrosin OE

 

Chemical formulas

Molecular formula and structural formula of 2-Phenylphenol:

 

C12H10O

Mr = 170.211 g/mol

[1,1´-Biphenyl]-2-ol
SMILES: C1=CC=C(C=C1)C2=CC=CC=C2O

 

Data and Properties

o-Phenylphenol, in its pure state, is a white to pink solid with a phenol-like odor.

solubility:
+ Soluble in alcohol, benzene; very soluble in diethyl ether, pyridine.
- Practically insoluble in water (0,56 g/L at 25 °C).
  partition coefficient logPOW = 3.18 at 22.5 °C.
melting point
56.7 °C
boiling point
287 °C
density
1.293 g cm-3 at 20 °C
pKa value
pK1a = 9.5 at 20 °C
vapor pressure
0.906 Pa at 25 °C

 

Spectroscopic data:

SPLASH (mass spectra)
splash10-00di-1900000000-f58c83912c81582962ec
splash10-00xr-2900000000-0395543c94def63fbf1c
splash10-00kf-9500000000-f6d4cbb6fefb881a66df
splash10-00kf-9500000000-645cd80d916513b7da2e
splash10-00di-0900000000-219245b8b29d73279657
splash10-00di-0900000000-7f22207002c737bb9aa3
MoNA Mass Bank of North America (mass spectrum)
LLEMOWNGBBNAJR-UHFFFAOYSA-N
SpectraBase (NMR, IR, FTIR, Raman, UV-Vis, MS ... spectra)
JFsQYtsYgBD
NIST IR-Spektrum
2-Phenylphenol
Human Metabolome Database (GC-MS, LC-MS/MS spectra, NMR)
HMDB0032582

Calculated NMR spectrum (Predict Spectra via NMRDB)
1H NMR Spektrum, 13C NMR Spektrum.

 

Percentage and isotopic composition:

Mass-related elemental composition and isotope proportions of the compound 2-Phenylphenol - C12H10O - calculated based on molecular mass.

Symbol
Element E
Number x
of atoms Ex
Data of the element
and isotopes *
Percentages
of isotopes
Percentage of
Ex in formula mass
C
Carbon
12 Ar = 12.011 u
ΣAr = 144.132 u
12C: 12 u [98,94 %]
14C: 14.00324 u [<< 1 %]
13C: 13.00335 u [1,06 %]
 
12C: 83.78084 %
14C: trace
13C: 0.89759 %
84.6784 %H
Hydrogen
10 Ar = 1.008 u
ΣAr = 10.08 u
3H: 3.01605 u [<< 1 %]
1H: 1.00783 u [99,99 %]
2H: 2.0141 u [0,01 %]
 
3H: trace
1H: 5.92147 %
2H: 0.00059 %
5.9221 %O
Oxygen
1ΣAr = 15.999 u
16O: 15.99491 u [99,757 %]
17O: 16.99913 u [0,03835 %]
18O: 17.99916 u [0,205 %]
 
16O: 9.37667 %
17O: 0.0036 %
18O: 0.01927 %
9.3995 %

*) The third column lists the atomic masses or isotope masses of the elements involved and - in square brackets - the natural isotope composition.

 

More calculated data

The molar mass is M = 170.211 grams per mole.

The amount of substance in one kilogram of the substance is n = 5.875 mol.

The amount of substance in one gram of the substance is n = 0.006 mol.

Monoisotopic mass: 170.073164941 Da - related to 12C121H1016O.

 

2-Phenylphenol as Active Ingredient

ATC Code:
D08AE06
D08AE56

o-Phenylphenol, under the name Biphenylol, is used in antiseptics and disinfectants - also in combination with other active ingredients.

For detailed information on the active ingredient, see: DrugBank DB13734.

 

Use in food

E-Nummer: E231 (deleted)

2-Phenylphenol is used as a biocide or preservative in food. This use is not permitted in the EU (formerly E-number E 231).

 

Use in Cosmetics

INCI Name: O-PHENYLPHENOL

EU-approved ingredient in cosmetic products used as a preservative. Caution: Avoid contact with eyes! For the use of o-phenylphenol as a preservative in cosmetics, a maximum concentration of 0.15% (as phenol) applies in leave-on products and 0.2% (as phenol) in rinse-off products.

Source: CosIng (Cosmetic Ingredient Database) number: 35733.

 

Pestizid

o-Phenylphenol is - like sodium 2-biphenylate - a fungicide used in agriculture - e.g. in the growth of citrus fruits or for disinfecting seed trays.

Status der EU-Zulassung: Siehe EU Pestizid-Datenbank ID 1013.

 

Hazard warnings according to GHS

(General information without guarantee of accuracy and completeness! The information does not replace the chemical safety data sheet or a risk assessment, but rather provides a general overview of the risk posed by the hazardous substance.

Signal word: Warning

GHS hazard statements (H phrases):


H315
Causes skin irritation

H319
Causes serious eye irritation

H335
May cause respiratory irritation

H400
Very toxic to aquatic life

H410
Very toxic to aquatic life with long lasting effects

LD50 (rat, oral): 2000 mg/kg.


Labeling in the EU: See ECHA Substance Infocard 100.001.812.

For toxicology and occupational safety when handling 2-Phenylphenol as well as measures to be taken in case of danger, see: Hazardous Substances Information System GESTIS, ZVG-Nr. 020480.

International Chemical Safety Card ICSC (SDS, MSDS): See ICSC: 0669.


Note: The labeling requirement according to the CLP Regulation (EU) does not apply, among other things, to certain substances and mixtures for end users that are in the form of finished products, such as pharmaceuticals, veterinary drugs, cosmetics, certain medical products and medical devices, food or feed, as well as certain Food additives or flavorings. Special legal regulations may need to be adhered to here.

 

External Sources

PubChem:ID 7017ChemSpider:ID 13839012Kegg database DBGET:ID D08367UNII of the FDA (USA):Unique Ingredient Identifier D343Z75HT8EPA CompTox Chemicals Dashboard:DTXSID2021151Other CAS RN:192076-92-9; 39387-78-5 (also used, outdated or deleted registration numbers)

 

Manufacturers and Sources of Supply

The table below lists producers and suppliers of 2-Phenylphenol as a commercial chemical for laboratories, research, industry and production with the corresponding contact details.

 

Literature Sources

[0] - Specialist and research articles in scientific journals via PubMed: 2-Phenylphenol.

 


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Last update: 2026-02-03


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