CAS 202865-77-8|2-bromo-4-fluoro-6-methylaniline|2-bromo-4-fluoro-6-methylaniline|2-Bromo-4-fluoro-6-methylaniline 98%|2-Bromo-4-fluoro-6-methylaniline|2-溴-4-氟-6-甲基苯胺|2-Bromo-4-fluoro-6-methyl...

Molecular Formula

C₇H₇BrFN

Molecular Mass

204.0395832

Exact Mass

202.97458945

InChI

InChI=1S/C7H7BrFN/c1-4-2-5(9)3-6(8)7(4)10/h2-3H,10H2,1H3

InChIKey

VTWSBILIFIFEFG-UHFFFAOYSA-N

Canonic Smiles

Fc1cc(C)c(c(c1)Br)N

Isomeric Smiles

Nc1c(cc(cc1C)F)Br

JChem

H Acceptors

H Donor

LogD (pH = 5.5)

2.5686781

LogD (pH = 7.4)

2.5691893

Log P

2.5691957

Molar Refractivity

43.6388

Polarizability

15.850146

Polar Surface Area

26.02

Rotatable Bonds

Lipinski's Rule of Five

true

Academic Data

PubChem

2773378

IUPAC name

2-bromo-4-fluoro-6-methylaniline

IUPAC Traditional name

2-bromo-4-fluoro-6-methylaniline

Synonyms

2-Bromo-4-fluoro-6-methylaniline 98%2-Bromo-4-fluoro-6-methylaniline2-溴-4-氟-6-甲基苯胺2-Bromo-4-fluoro-6-methylaniline

MDL Number

MFCD01861196

CAS Number

202865-77-8

PubChem SID

16208588024885041

Safety Information

Storage Warning

Irritant

MSDS Link

Download link

German water hazard class

European Hazard Symbols

Harmful (Xn)

GHS Signal Word

Warning

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

GHS Hazard statements

H302

Risk Statements

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

Product Information

Purity

97%

95+%

Empirical Formula (Hill Notation)

C7H7BrFN

Physical Property

Melting Point

32-36 °C

Flash Point

>110 °C

>230 °F

No Data Available

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No Data Available

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Sigma Aldrich

669369

Packaging
1, 10 g in glass bottle

No Data Available

Click here to submit data

Academic Data

PubChem

2773378

IUPAC name

2-bromo-4-fluoro-6-methylaniline

IUPAC Traditional name

2-bromo-4-fluoro-6-methylaniline

Synonyms

2-Bromo-4-fluoro-6-methylaniline 98%2-Bromo-4-fluoro-6-methylaniline2-溴-4-氟-6-甲基苯胺2-Bromo-4-fluoro-6-methylaniline

MDL Number

MFCD01861196

CAS Number

202865-77-8

PubChem SID

16208588024885041

Safety Information

Storage Warning

Irritant

MSDS Link

Download link

German water hazard class

European Hazard Symbols

Harmful (Xn)

GHS Signal Word

Warning

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

GHS Hazard statements

H302

Risk Statements

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

Product Information

Purity

97%

95+%

Empirical Formula (Hill Notation)

C7H7BrFN

Physical Property

Melting Point

32-36 °C

Flash Point

>110 °C

>230 °F

Sigma Aldrich

669369

Packaging
1, 10 g in glass bottle

No Data Available

Click here to submit data

Molecule

ID:99617