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Merck
CN

694754

S-(4-Cyanobutyl)thioacetate

97%

Synonym(s):

5-(Acetylsulfanyl)-pentanenitrile, S-(4-Cyanobutyl)ethanethioate, Thiolacetylpentanenitrile

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About This Item

Empirical Formula (Hill Notation):
C7H11NOS
CAS Number:
252949-42-1
Molecular Weight:
157.23
NACRES:
NA.23
PubChem Substance ID:
329761684
UNSPSC Code:
12352202
MDL number:
MFCD10567047

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InChI

1S/C7H11NOS/c1-7(9)10-6-4-2-3-5-8/h2-4,6H2,1H3

SMILES string

CC(=O)SCCCCC#N

InChI key

QZCVGPWTKIYEIZ-UHFFFAOYSA-N

assay

97%

form

liquid

refractive index

n20/D 1.487

density

1.057 g/mL at 25 °C

pictograms

Exclamation mark
GHS07

signalword

Warning

Hazard Classifications

Acute Tox. 4 Dermal - Acute Tox. 4 Inhalation - Acute Tox. 4 Oral

Storage Class

10 - Combustible liquids

wgk

WGK 3

flash_point_f

>230.0 °F

flash_point_c

> 110 °C

ppe

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

Regulatory Information

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Certificates of Analysis (COA)

Lot/Batch Number
09622MH

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