CAS 133863-87-3|2-methoxy-6-(trifluoromethyl)aniline|2-methoxy-6-(trifluoromethyl)aniline|2-Methoxy-6-(trifluoromethyl)aniline|2-Methoxy-6-(trifluoromethyl)aniline, JRD|2-甲氧基-6-(三氟甲基)苯胺, JRD

InChI=1S/C8H8F3NO/c1-13-6-4-2-3-5(7(6)12)8(9,10)11/h2-4H,12H2,1H3

GSJOHUUGUAFHKG-UHFFFAOYSA-N

COc1cccc(c1N)C(F)(F)F

Nc1c(cccc1C(F)(F)F)OC

Acid pKa

18.461447

H Acceptors

H Donor

LogD (pH = 5.5)

1.8641815

LogD (pH = 7.4)

1.8644931

Log P

1.8644971

Molar Refractivity

43.1953

Polarizability

15.225781

Polar Surface Area

35.25

Rotatable Bonds

Lipinski's Rule of Five

true

2-methoxy-6-(trifluoromethyl)aniline

IUPAC Traditional name

2-methoxy-6-(trifluoromethyl)aniline

2-Methoxy-6-(trifluoromethyl)aniline2-Methoxy-6-(trifluoromethyl)aniline, JRD2-甲氧基-6-(三氟甲基)苯胺, JRD

Purity

95+%

97%

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Names and Identifiers

IUPAC name

2-methoxy-6-(trifluoromethyl)aniline

IUPAC Traditional name

2-methoxy-6-(trifluoromethyl)aniline

Synonyms

2-Methoxy-6-(trifluoromethyl)aniline2-Methoxy-6-(trifluoromethyl)aniline, JRD2-甲氧基-6-(三氟甲基)苯胺, JRD

Registration numbers

CAS Number

MDL Number

PubChem CID

PubChem SID

References

PubChem Literature

No Data Available

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Bioactivity

PubChem BioAssay

Respiratory sensitization, category 1

Germ cell mutagenicity, categories 1A,1B,2

Carcinogenicity, categories 1A,1B,2

Reproductive toxicity, categories 1A,1B,2

Specific Target Organ Toxicity – Single exposure, categories 1,2

Specific Target Organ Toxicity – Repeated exposure, categories 1,2

Aspiration Hazard, category 1

GHS Hazard statements

European Hazard Symbols

GHS Precautionary statements

Molecule

ID:70404