CAS
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Octyl isothiocyanate
Catalog Number
ACMA00000550
Category
Alkanes
Molecular Weight
171.30
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Specification
Hazard Statements
H225-H304-H315-H336-H410
RIDADR
NONH for all modes of transport
Symbol
GHS02
What is the molecular formula of Octyl isothiocyanate?
The molecular formula of Octyl isothiocyanate is C9H17NS.
What is the molecular weight of Octyl isothiocyanate?
The molecular weight of Octyl isothiocyanate is 171.31 g/mol.
What is the IUPAC name of Octyl isothiocyanate?
The IUPAC name of Octyl isothiocyanate is 1-isothiocyanatooctane.
What is the InChI of Octyl isothiocyanate?
The InChI of Octyl isothiocyanate is InChI=1S/C9H17NS/c1-2-3-4-5-6-7-8-10-9-11/h2-8H2,1H3.
What is the InChIKey of Octyl isothiocyanate?
The InChIKey of Octyl isothiocyanate is YEZHGQZHWKJPCM-UHFFFAOYSA-N.
What is the canonical SMILES of Octyl isothiocyanate?
The canonical SMILES of Octyl isothiocyanate is CCCCCCCCN=C=S.
What is the CAS number of Octyl isothiocyanate?
The CAS number of Octyl isothiocyanate is 4430-45-9.
What is the European Community (EC) number of Octyl isothiocyanate?
The European Community (EC) number of Octyl isothiocyanate is 224-625-5.
What is the UNII of Octyl isothiocyanate?
The UNII of Octyl isothiocyanate is 9I83N3TI03.
Is Octyl isothiocyanate a canonicalized compound?
Yes, Octyl isothiocyanate is a canonicalized compound according to PubChem.
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