CAS 138526-69-9|5-bromo-1,2,3-trifluorobenzene|5-bromo-1,2,3-trifluorobenzene|1-Bromo-3,4,5-trifluorobenzene|3,4,5-Trifluorobromobenzene 99%|5-Bromo-1,2,3-trifluorobenzene|5-Bromo-1,2,3-trifluoroben...

Molecular Formula

C₆H₂BrF₃

Molecular Mass

210.9792896

Exact Mass

209.92919672

InChI

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

InChIKey

HKJCELUUIFFSIN-UHFFFAOYSA-N

Canonic Smiles

Brc1cc(F)c(c(c1)F)F

Isomeric Smiles

c1(Br)cc(F)c(F)c(F)c1

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

12.84018

Polar Surface Area

0.0

Rotatable Bonds

Lipinski's Rule of Five

true

Academic Data

PubChem

611409

IUPAC Traditional name

5-bromo-1,2,3-trifluorobenzene

IUPAC name

5-bromo-1,2,3-trifluorobenzene

Synonyms

1-Bromo-3,4,5-trifluorobenzene3,4,5-Trifluorobromobenzene 99%5-Bromo-1,2,3-trifluorobenzene5-Bromo-1,2,3-trifluorobenzene1-溴-3,4,5-三氟苯5-溴-1,2,3-三氟苯1-Bromo-3,4,5-trifluorobenzene3,4,5-Trifluorobromobenzene3,4,5-Trifluorobromobenzene

MDL Number

MFCD00070738

CAS Number

138526-69-9

Beilstein Number

7249191

TSCA Listed

false

否

Storage Warning

IRRITANT, FLAMMABLE

Flammable/Harmful/Irritant/Carcinogenic/Corrosive/Light Sensitive/Keep Cold

MSDS Link

Download link

European Hazard Symbols

Nature polluting (N)

Harmful (Xn)

Harmful (X)

Risk Statements

10-38-40-41-51/53

RID/ADR

UN 1993 3/PG 3

GHS Pictograms

Corrosive to metals, category 1

Skin corrosion, categories 1A,1B,1C

Serious eye damage, category 1

Hazardous to the aquatic environment

Acute hazard, category1

Chronic hazard, categories 1,2

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

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

Safety Statements

23-26-36/37/39-61

GHS Signal Word

Danger

GHS Precautionary statements

P273-P280-P305+P351+P338

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

Hazard Class

German water hazard class

GHS Hazard statements

H226-H315-H318-H351-H411

H318-H315-H226-H351-H411

Personal Protective Equipment

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

UN Number

1993

UN1993

Packing Group

III

Product Information