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Structure

3-METHOXYBENZYL ISOTHIOCYANATE

CAS
75272-77-4
Catalog Number
ACM75272774
Category
Other Products
Molecular Weight
179.24
Molecular Formula
C9H9NOS

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Specification

Synonyms
m-Methoxybenzylisothiocyanate, 3-Methoxybenzyl isothiocyanate, MolPort-000-156-763, CID126512, ZINC02528113, Benzene, 1-(isothiocyanatomethyl)-3-methoxy-, 75272-77-4
IUPAC Name
1-(isothiocyanatomethyl)-3-methoxybenzene
Canonical SMILES
COC1=CC=CC(=C1)CN=C=S
InChI Key
SSSDJJXWAVRNCM-UHFFFAOYSA-N
Boiling Point
120ºC 1mm
Flash Point
129.8ºC
Density
1.15 g/cm³
Exact Mass
179.04000
H-Bond Acceptor
2
H-Bond Donor
0
Safety Description
26-36/37/39
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