4-[[(1,1-Dioxido-1,2-benzisothiazol-3-yl)amino]methyl]benzoic acid

Name: 4-[[(1,1-Dioxido-1,2-benzisothiazol-3-yl)amino]methyl]benzoic acid
Brand: ChemScene
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CAS No. 743439-41-0
Cat. No. CS-0221464
Purity≥95%
MDL No.None

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Accessible (Haz class 3, 4, 5 or 8), Domestic	$158.00+
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4-[[(1,1-Dioxido-1,2-benzisothiazol-3-yl)amino]methyl]benzoic acid|CS-0221464

Structure of 743439-41-0

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General Information

CAS No. 743439-41-0
Cat. No. CS-0221464
Purity ≥95%
MDL No. None
Storage Sealed in dry,2-8℃
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₁₅H₁₂N₂O₄S
Molecular Weight 316.33
Synonym(s) 4-[[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]methyl]benzoic acid
SMILES O=C(O)C1=CC=C(CNC(C2=CC=CC=C23)=NS3(=O)=O)C=C1

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 95.83
LogP 1.6235
H_Acceptors 4
H_Donors 2
Rotatable_Bonds 3

Other Classifications

Building Blocks Functional Group Carboxylic Acid

Building Blocks Skeleton Aromatic heterocycle compounds Benzoisothiazole compounds

Building Blocks Skeleton Aromatic ring compounds Benzene compounds

Key Words

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4-[[(1,1-Dioxido-1,2-benzisothiazol-3-yl)amino]methyl]benzoic acid

CAS No. 743439-41-0

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