2-(~2~H_3_)Methyl(O-~2~H_5_)phenol

Basic Information

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CAS Number

203645-65-2

Molecular Formula

C7D8O

Molecular Weight

116.19 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Hydrocarbons

Basic Physical Properties

Melting Point

32-34 °C

Boiling Point

191 °C

Flash Point

178 °F

Refractive Index

n20/D 1.543(lit.)

SMILES

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CC1=CC=CC=C1O

InChI

InChI=1S/C7H8O/c1-6-4-2-3-5-7(6)8/h2-5,8H,1H3/i1D3,2D,3D,4D,5D/hD

InChIKey

QWVGKYWNOKOFNN-IWRLGKISSA-N

LogP

1.70062

Topological Polar Surface Area

20.23 Å²

Hydrogen Bond Donor/Acceptor

1 / 1

Complexity

70.8

Synonyms & References

English

2-Methylphenol D8
2-Methylphenol-d8
o-Cresol-d8
Phen-2,3,4,5-d4-ol-d, 6-(methyl-d3)- (9CI)
2-(~2~H_3_)Methyl(O-~2~H_5_)phenol
203645-65-2
DTXSID90583731
1-Hydroxy-d-2-methyl-d3-benzene-d4
J-013249
Phen-2,3,4,5-d4-ol-d, 6-(methyl-d3)- (9CI); o-Cresol-d8
o-Cresol-d8, 98 atom % D, 98% (CP)
SCHEMBL13863642
6-(methyl-d3)-Phen-2,3,4,5-d4-ol-d
D98971
1,2,3,4-tetradeuterio-5-deuteriooxy-6-(trideuteriomethyl)benzene
Phen-2,3,4,5-d4-ol-d,6-(methyl-d3)- (9CI)
Phenol-2,4,6-d3, OD
Phenol-2,4,6-d3, OD1000µg

MDL Number

MFCD00145023

FAQ

What is 2-(~2~H_3_)Methyl(O-~2~H_5_)phenol (CAS: 203645-65-2)?

2-(~2~H_3_)Methyl(O-~2~H_5_)phenol, also known as 2-(2-Deuterio-methyl)(o-2-deuterio-ethyl)phenol (CAS: 203645-65-2), is a phenolic compound with a unique deuterium substitution pattern. It possesses antioxidant properties and is used in various research applications due to its structural uniqueness.

What are the main uses of 2-(~2~H_3_)Methyl(O-~2~H_5_)phenol (CAS: 203645-65-2)?

2-(~2~H_3_)Methyl(O-~2~H_5_)phenol (CAS: 203645-65-2) is primarily used in academia for its unique deuterium substitution pattern, which makes it useful in studying reaction mechanisms and as a stable isotope marker in biological and chemical research. It is also used in pharmaceutical research for its antioxidant properties.

Is 2-(~2~H_3_)Methyl(O-~2~H_5_)phenol (CAS: 203645-65-2) safe?

2-(~2~H_3_)Methyl(O-~2~H_5_)phenol (CAS: 203645-65-2) is generally considered safe when handled with appropriate precautions. However, it is recommended to avoid contact with skin and eyes, and to use appropriate personal protective equipment. It should be stored away from sources of heat and light to prevent degradation.

How should 2-(~2~H_3_)Methyl(O-~2~H_5_)phenol (CAS: 203645-65-2) be stored?

2-(~2~H_3_)Methyl(O-~2~H_5_)phenol (CAS: 203645-65-2) should be stored in a cool, dry place away from direct sunlight and heat sources. It is best kept in a tightly sealed container to prevent light and moisture exposure, which could affect its stability. Keep it in a secure location away from ignition sources and incompatible materials.