ChemicalBook--->CAS DataBase List--->4165-62-2

4165-62-2

4165-62-2 Structure

4165-62-2 Structure
IdentificationBack Directory
[Name]

PHENOL-2,3,4,5,6-D5
[CAS]

4165-62-2
[Synonyms]

PHENOL D5
Phen-d5-ol
PHENOL (RING-D5)
PHENOL-2,3,4,5,6-D5
PHENOL-2,3,4,5,6-D5, 98 ATOM % D
[EINECS(EC#)]

604-604-1
[Molecular Formula]

C6HD5O
[MDL Number]

MFCD00084164
[MOL File]

4165-62-2.mol
[Molecular Weight]

99.14
Chemical PropertiesBack Directory
[Appearance]

solid
[Melting point ]

40-42 °C(lit.)
[Boiling point ]

182 °C(lit.)
[density ]

1.127 g/mL at 25 °C
[Fp ]

175 °F
[solubility ]

Acetonitrile (Slightly), Chloroform (Slightly), Ethyl Acetate (Slightly), Methan
[form ]

Low-Melting Solid
[color ]

White to Off-White
[Stability:]

Stable, but may be moisture sensitive. May be light sensitive. Combustible. Incompatible with strong oxidizing agents.
[InChI]

InChI=1S/C6H6O/c7-6-4-2-1-3-5-6/h1-5,7H
[InChIKey]

ISWSIDIOOBJBQZ-RALIUCGRSA-N
[SMILES]

OC1C([H])=C([H])C([H])=C([H])C=1[H]
[CAS DataBase Reference]

4165-62-2
[EPA Substance Registry System]

Phenol-d5 (4165-62-2)
[CAS Number Unlabeled]

108-95-2
Hazard InformationBack Directory
[Chemical Properties]

solid
[Uses]

Phenol is purified here for molecular genetics applications. It is naturally found in tea leaves and plants, and has uses in the synthesis of antioxidant compounds due to the antioxidant activity caus ed by the phenol moiety. This structure also allows it to be used for syntheses of anti-bacterial & anti-carcinogenic compounds. This is the labelled analog.
[General Description]

Phenol-2,3,4,5,6-d5 is an isotope-labeled analog of phenol, wherein 2,3,4, 5, and 6th protons of phenol are replaced by deuterium.
Safety DataBack Directory
[Hazard Codes ]

T,C
[Risk Statements ]

23/24/25-34-48/20/21/22-68
[Safety Statements ]

24/25-26-28-36/37/39-45
[RIDADR ]

UN 1671 6.1/PG 2
[WGK Germany ]

2
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