4-Isopropylphenyl isothiocyanate

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Catalog Number

ACM89007454

Product Name

Structure

CAS

89007-45-4

Category

Heterocyclic Organic Compound

Synonyms

4-Isopropylphenyl isothiocyanate, 1-Isopropyl-4-isothiocyanatobenzene, ZINC00164728, BB_SC-1817, CID145194, 89007-45-4

IUPAC Name

1-isothiocyanato-4-propan-2-ylbenzene

Molecular Weight

177.27

Molecular Formula

C₁₀H₁₁NS

Canonical SMILES

CC(C)C1=CC=C(C=C1)N=C=S

InChI Key

SNWJJTIJIDXIHL-UHFFFAOYSA-N

Boiling Point

154-155ºC (20 torr)

Flash Point

154-155°C/20mm

Density

1.03

Exact Mass

177.06100

Hazard Statements

Xn:Harmful;

H-Bond Acceptor

H-Bond Donor

Packing Group

Safety Description

S26-S36/37/39

MSDS

COA

Spec Sheet

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