2-((1,1-Dioxidobenzo[d]isothiazol-3-yl)thio)acetonitrile

Name: 2-((1,1-Dioxidobenzo[d]isothiazol-3-yl)thio)acetonitrile
Brand: ChemScene
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CAS No. 80357-08-0
Cat. No. CS-0672291
Purity≥98%
MDL No.MFCD22576761

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Type	HazMat Fee
Excepted Quantity	$0.00
FedEx Limited Quantities Ground	$0.00
Hazmat Ground shipping	$50.00+
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Accessible (Haz class 3, 4, 5 or 8), Domestic	$158.00+
Inaccessible (Haz class 6.1 or 9), International	$108.00+
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2-((1,1-Dioxidobenzo[d]isothiazol-3-yl)thio)acetonitrile|CS-0672291

Structure of 80357-08-0

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General Information

CAS No. 80357-08-0
Cat. No. CS-0672291
Purity ≥98%
MDL No. MFCD22576761
Storage Sealed in dry,2-8℃
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₉H₆N₂O₂S₂
Molecular Weight 238.29
Synonym(s) None
SMILES C1=CC=C2C(=C1)C(=NS2(=O)=O)SCC#N

Safety Information

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GHS Pictogram : N/A	GHS No : N/A
Signal Word : N/A	UN#: N/A
Class : N/A	Packing Group : N/A
Hazard Statements : N/A
Precautionary Statements : N/A

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Computational Chemistry Data

TPSA 70.29
LogP 1.39228
H_Acceptors 4
H_Donors 0
Rotatable_Bonds 1

Other Classifications

Building Blocks Functional Group Thioether

Building Blocks Functional Group Cyanide/Nitrile

Building Blocks Skeleton Aromatic heterocycle compounds Other aromatic heterocycles compounds

Key Words

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2-((1,1-Dioxidobenzo[d]isothiazol-3-yl)thio)acetonitrile

CAS No. 80357-08-0

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