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375047

Sigma-Aldrich

4-(Chloromethyl)phenyl isocyanate

97%

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About This Item

Fórmula linear:
ClCH2C6H4NCO
Número CAS:
29173-65-7
Peso molecular:
167.59
Número MDL:
MFCD00134403
Código UNSPSC:
12352100
ID de substância PubChem:
24863357
NACRES:
NA.22

Ensaio

97%

forma

solid

pf

32-33 °C (lit.)

densidade

1.216 g/mL at 25 °C (lit.)

temperatura de armazenamento

2-8°C

cadeia de caracteres SMILES

ClCc1ccc(cc1)N=C=O

InChI

1S/C8H6ClNO/c9-5-7-1-3-8(4-2-7)10-6-11/h1-4H,5H2

chave InChI

OBYMZHLTKVXPQF-UHFFFAOYSA-N

Categorias relacionadas

Descrição geral

4-(Chloromethyl)phenyl isocyanate is an aryl isocyanate. It is reported to participate in the anomeric O-acylation of Kdo.

Aplicação

4-(Chloromethyl)phenyl isocyanate may be used in the synthesis of series of carbamate derivatives of Hoechst 33258, potential anticancer agents.

Pictogramas

Health hazardExclamation mark
GHS08,GHS07

Palavra indicadora

Danger

Classificações de perigo

Acute Tox. 4 Dermal - Acute Tox. 4 Inhalation - Acute Tox. 4 Oral - Eye Irrit. 2 - Resp. Sens. 1 - Skin Irrit. 2 - Skin Sens. 1 - STOT SE 3

Órgãos-alvo

Respiratory system

Código de classe de armazenamento

11 - Combustible Solids

Classe de risco de água (WGK)

WGK 3

Ponto de fulgor (°F)

235.4 °F - closed cup

Ponto de fulgor (°C)

113 °C - closed cup

Equipamento de proteção individual

dust mask type N95 (US), Eyeshields, Gloves

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Tsuyoshi Ichiyanagi et al.
Carbohydrate research, 340(17), 2682-2687 (2005-10-04)
To develop a convenient method for the preparation of an alpha-Kdo derivative carrying a functional spacer at the reducing end, we examined anomeric O-acylation using Kdo and halogenated alkyl/aryl isocyanates as nucleophile and electrophiles, respectively. Reaction of a Kdo derivative
Krzysztof Bielawski et al.
Biological & pharmaceutical bulletin, 25(7), 916-919 (2002-07-23)
A series of carbamate derivatives of Hoechst 33258 was prepared as potential anticancer agents. These new compounds (1-4) were readily prepared in good yields by addition of chloroethyl, bromoethyl, chloropropyl or 4-(chloromethyl)phenyl isocyanates to Hoechst 33258. Their cytotoxic activity was
Ashraf Ali et al.
Journal of separation science, 40(12), 2654-2661 (2017-05-06)
A specially designed long open tubular capillary column (50 μm internal diameter and 112 cm effective length) was prepared by fabrication of a thin three-component co-polymer layer on the inner surface of silica capillary. A pretreated silica capillary was reacted with 4-(chloromethyl)phenyl

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