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87-40-1

87-40-1 Structure

87-40-1 Structure
IdentificationMore
[Name]

2,4,6-TRICHLOROANISOLE
[CAS]

87-40-1
[Synonyms]

2,4,6-TRICHLOROANISOL
2,4,6-TRICHLOROANISOLE
2,4,6-TRICHLOROMETHOXYBENZENE
TYRENE
1,3,5-Trichloro-2-methoxybenzene
1,3,5-Trichloro-2-methoxy-benzene
Anisole, 2,4,6-trichloro-
Methyl 2,4,6-trichlorophenyl ether
Trichloroanisole
2,4,6-TRICHLOROANISOLE PESTANAL, 100 MG
2,4,6-trichloro-1-methoxybenzene
2,4,6-trichloroanisole solution
2,4,6-Trichloroanisole Odor Standard
1-Methoxy-2,4,6-trichlorobenzene
[EINECS(EC#)]

201-743-5
[Molecular Formula]

C7H5Cl3O
[MDL Number]

MFCD00000588
[Molecular Weight]

211.47
[MOL File]

87-40-1.mol
Chemical PropertiesBack Directory
[Appearance]

white or off-white fibrous powder
[Melting point ]

60-62 °C (lit.)
[Boiling point ]

132 °C/28 mmHg (lit.)
[density ]

1.6400
[refractive index ]

1.5510 (estimate)
[Fp ]

11 °C
[storage temp. ]

room temp
[solubility ]

benzene: soluble(lit.)
[form ]

powder to crystal
[color ]

White to Almost white
[Stability:]

Stable. Incompatible with strong oxidizing agents.
[Water Solubility ]

13.2mg/L(25 ºC)
[Merck ]

13,9702
[BRN ]

2329219
[InChI]

1S/C7H5Cl3O/c1-11-7-5(9)2-4(8)3-6(7)10/h2-3H,1H3
[InChIKey]

WCVOGSZTONGSQY-UHFFFAOYSA-N
[SMILES]

COc1c(Cl)cc(Cl)cc1Cl
[LogP]

4.110
[Uses]

Dyeing auxiliary for polyester fabrics.
[CAS DataBase Reference]

87-40-1(CAS DataBase Reference)
[EPA Substance Registry System]

Benzene, 1,3,5-trichloro-2-methoxy- (87-40-1)
Safety DataBack Directory
[Hazard Codes ]

Xn,T,F
[Risk Statements ]

R22:Harmful if swallowed.
R36:Irritating to the eyes.
R39/23/24/25:Toxic: danger of very serious irreversible effects through inhalation, in contact with skin and if swallowed .
R23/24/25:Toxic by inhalation, in contact with skin and if swallowed .
R11:Highly Flammable.
[Safety Statements ]

S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S45:In case of accident or if you feel unwell, seek medical advice immediately (show label where possible) .
S36/37:Wear suitable protective clothing and gloves .
S16:Keep away from sources of ignition-No smoking .
S7:Keep container tightly closed .
[RIDADR ]

UN 1230 3/PG 2
[WGK Germany ]

3
[HS Code ]

2909.30.6000
[Storage Class]

11 - Combustible Solids
[Hazard Classifications]

Acute Tox. 4 Oral
Aquatic Chronic 4
Eye Irrit. 2
Hazard InformationBack Directory
[Chemical Properties]

white or off-white fibrous powder. Insoluble in water; soluble in benzene, methanol, and dioxane; gradually sublimes at room temperature.
[Definition]

ChEBI: A monomethoxybenzene that is 1,3,5-trichlorobenzene in which one of the hydrogens is replaced by a methoxy group.
[General Description]

2,4,6-Trichloroanisole (TCA) is responsible for the cork taint in wines. TCA has been quantitated in bark cork stoppers by supercritical fluid extraction (SFE) method. Degradation of TCA catalyzed by raw bauxite via ozonation in water has been investigated.
Spectrum DetailBack Directory
[Spectrum Detail]

2,4,6-TRICHLOROANISOLE(87-40-1)MS
2,4,6-TRICHLOROANISOLE(87-40-1)1HNMR
2,4,6-TRICHLOROANISOLE(87-40-1)13CNMR
2,4,6-TRICHLOROANISOLE(87-40-1)IR1
2,4,6-TRICHLOROANISOLE(87-40-1)IR2
2,4,6-TRICHLOROANISOLE(87-40-1)Raman
Well-known Reagent Company Product InformationBack Directory
[Sigma Aldrich]

87-40-1(sigmaaldrich)
[TCI AMERICA]

2,4,6-Trichloroanisole,>98.0%(GC)(87-40-1)
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