CAS
403-54-3 Purity
98%+
403-54-3 Purity
98%+
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3-Fluorophenyl isothiocyanate
CAS
404-72-8
Catalog Number
ACM404728
Category
Aryl Fluorinated Building Blocks
Molecular Weight
153.18
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Specification
Hazard Statements
H302-H318
RIDADR
NONH for all modes of transport
Symbol
GHS05
What is the molecular formula of 3-Fluorophenyl isothiocyanate?
The molecular formula of 3-Fluorophenyl isothiocyanate is C7H4FNS.
What is the molecular weight of 3-Fluorophenyl isothiocyanate?
The molecular weight of 3-Fluorophenyl isothiocyanate is 153.18 g/mol.
What is the IUPAC name of 3-Fluorophenyl isothiocyanate?
The IUPAC name of 3-Fluorophenyl isothiocyanate is 1-fluoro-3-isothiocyanatobenzene.
What is the InChI of 3-Fluorophenyl isothiocyanate?
The InChI of 3-Fluorophenyl isothiocyanate is InChI=1S/C7H4FNS/c8-6-2-1-3-7(4-6)9-5-10/h1-4H.
What is the InChIKey of 3-Fluorophenyl isothiocyanate?
The InChIKey of 3-Fluorophenyl isothiocyanate is HDBACITVPQEAGG-UHFFFAOYSA-N.
What is the canonical SMILES of 3-Fluorophenyl isothiocyanate?
The canonical SMILES of 3-Fluorophenyl isothiocyanate is C1=CC(=CC(=C1)F)N=C=S.
What is the CAS number of 3-Fluorophenyl isothiocyanate?
The CAS number of 3-Fluorophenyl isothiocyanate is 404-72-8.
What is the XLogP3 value of 3-Fluorophenyl isothiocyanate?
The XLogP3 value of 3-Fluorophenyl isothiocyanate is 3.5.
How many hydrogen bond donor counts does 3-Fluorophenyl isothiocyanate have?
3-Fluorophenyl isothiocyanate does not have any hydrogen bond donor counts (0).
How many hydrogen bond acceptor counts does 3-Fluorophenyl isothiocyanate have?
3-Fluorophenyl isothiocyanate has 3 hydrogen bond acceptor counts.
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