CAS 1435-44-5|1-chloro-2,4-difluorobenzene|1-chloro-2,4-difluorobenzene|1-Chloro-2,4-difluorobenzene|1-Chloro-2,4-difluorobenzene|1-Chloro-2,4-difluorobenzene 98%|2,4-二氟氯苯|1-氯-2,4-二氟苯|2,4-Di...

Molecular Formula

C₆H₃ClF₂

Molecular Mass

148.5378264

Exact Mass

147.98913422

InChI

InChI=1S/C6H3ClF2/c7-5-2-1-4(8)3-6(5)9/h1-3H

InChIKey

AJCSNHQKXUSMMY-UHFFFAOYSA-N

Canonic Smiles

Fc1ccc(c(c1)F)Cl

Isomeric Smiles

c1(F)c(Cl)ccc(c1)F

JChem

H Acceptors

H Donor

LogD (pH = 5.5)

2.8626943

LogD (pH = 7.4)

2.8626943

Log P

2.8626943

Molar Refractivity

31.2956

Polarizability

11.7450285

Polar Surface Area

0.0

Rotatable Bonds

Lipinski's Rule of Five

true

Academic Data

PubChem

137001

IUPAC Traditional name

1-chloro-2,4-difluorobenzene

IUPAC name

1-chloro-2,4-difluorobenzene

Synonyms

1-Chloro-2,4-difluorobenzene1-Chloro-2,4-difluorobenzene1-Chloro-2,4-difluorobenzene 98%2,4-二氟氯苯1-氯-2,4-二氟苯2,4-Difluorochlorobenzene

CAS Number

MDL Number

Beilstein Number

PubChem SID

Product Information

Purity

95%

98%

Linear Formula

ClC6H3F2

TSCA Listed

false

否

Storage Warning

IRRITANT

Flammable/Irritant

H226-H315-H319-H335

16-26-36/37/39

23-26-37

P261-P305+P351+P338

P261-P280G-P305+P351+P338

UN 1993 3/PG 3

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

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

1993

UN1993

Physical Property

No Data Available

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No Data Available

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Sigma Aldrich

335789

Packaging
25, 100 g in glass bottle

No Data Available

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Academic Data

PubChem

137001

IUPAC Traditional name

1-chloro-2,4-difluorobenzene

IUPAC name

1-chloro-2,4-difluorobenzene

Synonyms

1-Chloro-2,4-difluorobenzene1-Chloro-2,4-difluorobenzene1-Chloro-2,4-difluorobenzene 98%2,4-二氟氯苯1-氯-2,4-二氟苯2,4-Difluorochlorobenzene

CAS Number

MDL Number

Beilstein Number

PubChem SID

335789

Packaging
25, 100 g in glass bottle

No Data Available

Click here to submit data

Product Information

Purity

95%

98%

Linear Formula

ClC6H3F2

Safety Information

Physical Property

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

Flash Point

32°C

91.4 °F

33 °C

32°C(89°F)

Melting Point

-26°C

Hydrophobicity(logP)

3.141

Molecule

ID:7047