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Merck
CN

456179

Phenethyl isocyanate

98%

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About This Item

Linear Formula:
C6H5CH2CH2NCO
CAS Number:
Molecular Weight:
147.17
NACRES:
NA.22
PubChem Substance ID:
UNSPSC Code:
12352100
EC Number:
413-080-0
MDL number:
Assay:
98%
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Quality Segment

assay

98%

refractive index

n20/D 1.522 (lit.)

bp

210 °C (lit.)

density

1.063 g/mL at 25 °C (lit.)

functional group

amine, isocyanate, phenyl

SMILES string

O=C=NCCc1ccccc1

InChI

1S/C9H9NO/c11-8-10-7-6-9-4-2-1-3-5-9/h1-5H,6-7H2

InChI key

HACRKYQRZABURO-UHFFFAOYSA-N



signalword

Danger

Hazard Classifications

Acute Tox. 3 Inhalation - Acute Tox. 4 Oral - Aquatic Chronic 2 - Resp. Sens. 1 - Skin Corr. 1A - Skin Sens. 1

flash_point_f

212.0 °F - closed cup

flash_point_c

100 °C - closed cup

ppe

Faceshields, Gloves, Goggles, type ABEK (EN14387) respirator filter

Storage Class

6.1A - Combustible acute toxic Cat. 1 and 2 / very toxic hazardous materials



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