CAS 176793-04-7|1-Bromo-2,3,6-trifluorobenzene 98%|2-bromo-1,3,4-trifluorobenzene|2-bromo-1,3,4-trifluorobenzene|2,3,6-Trifluorobromobenzene|2-溴-1,3,4-三氟苯|2,3,6-Trifluorobromobenzene|2-Bromo-1,3...

Molecular Formula

C₆H₂BrF₃

Molecular Mass

210.9792896

Exact Mass

209.92919672

InChI

InChI=1S/C6H2BrF3/c7-5-3(8)1-2-4(9)6(5)10/h1-2H

InChIKey

CNAXDCSHYHIOGW-UHFFFAOYSA-N

Canonic Smiles

Fc1ccc(c(c1Br)F)F

Isomeric Smiles

Fc1c(c(ccc1F)F)Br

JChem

H Acceptors

H Donor

LogD (pH = 5.5)

3.1701043

LogD (pH = 7.4)

3.1701043

Log P

3.1701043

Molar Refractivity

34.33

Polarizability

12.853994

Polar Surface Area

0.0

Rotatable Bonds

Lipinski's Rule of Five

true

Academic Data

PubChem

2736401

Synonyms

1-Bromo-2,3,6-trifluorobenzene 98%2,3,6-Trifluorobromobenzene2-溴-1,3,4-三氟苯2,3,6-Trifluorobromobenzene2-Bromo-1,3,4-trifluorobenzene

IUPAC Traditional name

2-bromo-1,3,4-trifluorobenzene

IUPAC name

2-bromo-1,3,4-trifluorobenzene

CAS Number

176793-04-7

MDL Number

MFCD00236214

PubChem SID

162086424

Physical Property

Refractive Index

1.4895

Flash Point

62°C(143°F)

Safety Information

Storage Warning

Irritant

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

Risk Statements

36/37/38

European Hazard Symbols

Irritant (Xi)

GHS Precautionary statements

P210-P305+P351+P338-P302+P352-P321-P405-P501A

Safety Statements

26-37

GHS Hazard statements

H315-H319-H335-H227

TSCA Listed

否

Product Information

Purity

97%

No Data Available

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Academic Data

PubChem

2736401

Synonyms

1-Bromo-2,3,6-trifluorobenzene 98%2,3,6-Trifluorobromobenzene2-溴-1,3,4-三氟苯2,3,6-Trifluorobromobenzene2-Bromo-1,3,4-trifluorobenzene

IUPAC Traditional name

2-bromo-1,3,4-trifluorobenzene

IUPAC name

2-bromo-1,3,4-trifluorobenzene

CAS Number

176793-04-7

MDL Number

MFCD00236214

PubChem SID

162086424

Physical Property

Refractive Index

1.4895

Flash Point

62°C(143°F)

Safety Information

Storage Warning

Irritant

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

Risk Statements

36/37/38

European Hazard Symbols

Irritant (Xi)

GHS Precautionary statements

P210-P305+P351+P338-P302+P352-P321-P405-P501A

Safety Statements

26-37

GHS Hazard statements

H315-H319-H335-H227

TSCA Listed

否

Product Information

Purity

97%

No Data Available

Click here to submit data

Molecule

ID:100151