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Orcinol

Orcinol structure

Orcinol 

structure
  • CAS No:

    504-15-4

  • Formula:

    C7H8O2

  • Chemical Name:

    Orcinol

  • Synonyms:

    1,3-Benzenediol,5-methyl-;Resorcinol,5-methyl-;5-Methyl-1,3-benzenediol;1,3-Dihydroxy-5-methylbenzene;3,5-Dihydroxytoluene;5-Methylresorcinol;Orcin;Orcinol;3-Hydroxy-5-methylphenol;5-Methyl-1,3-dihydroxybenzene;1,5-Dihydroxy-3-methylbenzene;NSC 12441

  • Categories:

    Organic Chemistry  >  Hydrocarbons and Derivatives

Description

Orcinol (3,5-Dihydroxytoluene) is an organic compound used as biological dye and indicator for proteomics research.


Orcinol is a 5-alkylresorcinol in which the alkyl group is specified as methyl. It has a role as an Aspergillus metabolite. It is a 5-alkylresorcinol and a dihydroxytoluene.

Orcinol Basic Attributes

124.14

124.14

1071903

207-984-2

534PMB3438

12441

DTXSID2060123

29072900

Characteristics

40.5

1.6

Pink-gray to pink-brown Crystalline Powder or Crystals

1.2±0.1 g/cm3

107.5 °C

289.5 °C

159 °C

1.595

Store at<= 20°C.

LD50 orally in Rabbit: > 2000 mg/kg LD50 dermal Rabbit > 5000 mg/kg

Safety Information

III

2811

3

22-36/37/38-41-37/38-20/21/22

22-26-36-37/39

VH2100000

Xn

Stable under normal temperatures and pressures. Substance may discolor on exposure to light.

P261-P305 + P351 + P338

H302-H315-H319-H335

Drug Information

Substances used for the detection, identification, analysis, etc. of chemical, biological, or pathologic processes or conditions. Indicators are substances that change in physical appearance, e.g., color, at or approaching the endpoint of a chemical titration, e.g., on the passage between acidity and alkalinity. Reagents are substances used for the detection or determination of another substance by chemical or microscopical means, especially analysis. Types of reagents are precipitants, solvents, oxidizers, reducers, fluxes, and colorimetric reagents. (From Grant and Hackh's Chemical Dictionary, 5th ed, p301, p499) (See all compounds classified as Indicators and Reagents.)

3,5-dihydroxytoluene

Orcinol Use and Manufacturing

Uses

Used as analytical reagent

1,3-Benzenediol, 5-methyl-: ACTIVE

Computed Properties

Molecular Weight:124.14
XLogP3:1.6
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:2
Exact Mass:124.052429494
Monoisotopic Mass:124.052429494
Topological Polar Surface Area:40.5
Heavy Atom Count:9
Complexity:82.9
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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