CAS 6140-17-6|1-methyl-4-(trifluoromethyl)benzene|4-Methylbenzotrifluoride|1-methyl-4-(trifluoromethyl)benzene|4-Methylbenzotrifluoride 98%|4-(Trifluoromethyl)toluene|4-Methylbenzotrifluoride|4-甲基...

InChI=1S/C8H7F3/c1-6-2-4-7(5-3-6)8(9,10)11/h2-5H,1H3

LRLRAYMYEXQKID-UHFFFAOYSA-N

c1c(ccc(c1)C(F)(F)F)C

H Acceptors

H Donor

LogD (pH = 5.5)

3.3645158

LogD (pH = 7.4)

3.3645158

Log P

3.3645158

Molar Refractivity

37.0729

Polarizability

13.205056

Polar Surface Area

0.0

Rotatable Bonds

Lipinski's Rule of Five

true

IUPAC Traditional name

1-methyl-4-(trifluoromethyl)benzene

4-Methylbenzotrifluoride4-Methylbenzotrifluoride 98%4-(Trifluoromethyl)toluene4-Methylbenzotrifluoride4-甲基三氟甲苯alpha,alpha,alpha-Trifluoro-p-xyleneα,α,α-三氟-对二甲苯α,α,α-Trifluoro-p-xylene1-Methyl-4-(trifluoromethyl)benzene

1-methyl-4-(trifluoromethyl)benzene

CH3C6H4CF3

98%

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365866

Packaging
1 g in glass bottle

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Names and Identifiers

IUPAC Traditional name

1-methyl-4-(trifluoromethyl)benzene

Synonyms

IUPAC name

1-methyl-4-(trifluoromethyl)benzene

Registration numbers

CAS Number

MDL Number

PubChem SID

EC Number

Beilstein Number

PubChem CID

Molecule Details

365866

Packaging
1 g in glass bottle

References

PubChem Literature

No Data Available

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Bioactivity

PubChem BioAssay

Packing Group

III

UN Number

1993

UN1993

Hazard Class

German water hazard class

Safety Statements

16-26-36/37/39

23-26-37

GHS Pictograms

Acute toxicity (oral, dermal, inhalation), category 4

Skin irritation, category 2

Eye irritation, category 2

Skin sensitisation, category 1

Specific Target Organ Toxicity – Single exposure, category 3

Flammable gases, category 1

Flammable aerosols, categories 1,2

Flammable liquids, categories 1,2,3

Self-reactive substances and mixtures, Types B,C,D,E,F

Pyrophoric liquids, category 1

Pyrophoric solids, category 1

Self-heating substances and mixtures

Substances and mixtures, which in contact with water, emit flammable gases, categories 1,2,3

Organic peroxides, Types B,C,D,E,F

European Hazard Symbols

Irritant (Xi)

Personal Protective Equipment

Eyeshields, Faceshields, full-face respirator (US), Gloves, multi-purpose combination respirator cartridge (US), type ABEK (EN14387) respirator filter

GHS Precautionary statements

P261-P305+P351+P338

P210-P241-P303+P361+P353-P305+P351+P338-P405-P501A

GHS Hazard statements

H226-H315-H319-H335

GHS Signal Word

Warning

Risk Statements

10-36/37/38

RID/ADR

UN 1993 3/PG 3

Molecule

ID:7971