CAS 37408-18-7|4-chloro-1-isocyanato-2-methylbenzene|4-chloro-1-isocyanato-2-methylbenzene|4-CHLORO-2-METHYLPHENYLISOCYANATE|4-Chloro-2-methylphenyl isocyanate|4-氯-2-甲基苯基异氰酸酯

InChI=1S/C8H6ClNO/c1-6-4-7(9)2-3-8(6)10-5-11/h2-4H,1H3

FTZJLXIATZSKIL-UHFFFAOYSA-N

H Acceptors

H Donor

LogD (pH = 5.5)

3.0002675

LogD (pH = 7.4)

3.0002675

Log P

3.0002675

Molar Refractivity

44.976

Polarizability

16.292126

Polar Surface Area

29.43

Rotatable Bonds

Lipinski's Rule of Five

true

IUPAC Traditional name

4-chloro-1-isocyanato-2-methylbenzene

4-CHLORO-2-METHYLPHENYLISOCYANATE4-Chloro-2-methylphenyl isocyanate4-氯-2-甲基苯基异氰酸酯

Certificate of Analysis

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Linear Formula

ClC6H3(CH3)NCO

Purity

97%

98%

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05209733

MP Biomedicals Rare Chemical collection

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Data Source

Academic Data

Commercial Catalog

Names and Identifiers

IUPAC Traditional name

4-chloro-1-isocyanato-2-methylbenzene

IUPAC name

4-chloro-1-isocyanato-2-methylbenzene

Synonyms

4-CHLORO-2-METHYLPHENYLISOCYANATE4-Chloro-2-methylphenyl isocyanate4-氯-2-甲基苯基异氰酸酯

Registration numbers

CAS Number

PubChem SID

PubChem CID

MDL Number

Beilstein Number

Molecule Details

MP Biomedicals Rare Chemical collection

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

Acute toxicity (oral, dermal, inhalation), categories 1,2,3

GHS Precautionary statements

GHS Hazard statements

European Hazard Symbols

Personal Protective Equipment

German water hazard class

Molecule

ID:109072