Benzothioamide

Name: Benzothioamide
Brand: ChemScene
Availability: InStock
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CAS No. 2227-79-4
Cat. No. CS-W016517
Purity≥98%
MDL No.MFCD00008060

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Type	HazMat Fee
Excepted Quantity	$0.00
FedEx Limited Quantities Ground	$0.00
Hazmat Ground shipping	$50.00+
Inaccessible (Haz class 6.1 or 9), Domestic	$68.00+
Accessible (Haz class 3, 4, 5 or 8), Domestic	$158.00+
Inaccessible (Haz class 6.1 or 9), International	$108.00+
Accessible (Haz class 3, 4, 5 or 8), International	$238.00+

An item is classified as a dangerous good if our website displays Hazardous Material (HazMat) information for it.

There is a HazMat shipping fee for each item that qualifies as a dangerous good. Please contact our quotation team via email to confirm the details.

*For research and further manufacturing use only, not for direct human use.

Structure of 2227-79-4

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Description

Benzothioamide features a fused benzene-thioamide core that imparts enhanced stability and electron-rich character. This scaffold integrates readily into pharmaceutical intermediates, where its sulfur-containing functionality enables selective coordination in transition metal catalysis. The compound exhibits robust performance under standard bench conditions, facilitating efficient incorporation into complex molecular architectures.

Application

Benzothioamide serves as a versatile building block in synthetic organic chemistry, enabling efficient construction of thiazole and benzothiazole scaffolds via cyclization reactions. Its stable, bench-ready nature and tolerance to diverse functional groups facilitate reliable incorporation into complex molecular architectures. The molecule functions effectively in coupling processes and acts as a key intermediate in the development of heterocyclic compounds with established utility in medicinal chemistry and materials science.

General Information

CAS No. 2227-79-4
Cat. No. CS-W016517
Purity ≥98%
MDL No. MFCD00008060
Storage Store at room temperature
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₇H₇NS
Molecular Weight 137.20
Synonym(s) Thiobenzamide
SMILES NC(C1=CC=CC=C1)=S

Computational Chemistry Data

TPSA 26.02
LogP 1.3208
H_Acceptors 1
H_Donors 1
Rotatable_Bonds 1

Safety Information

Download SDS

GHS Pictogram :	GHS No : GHS06
Signal Word : Danger	UN#: 2811
Class : 6.1	Packing Group : Ⅲ
Hazard Statements : H301
Precautionary Statements : P264-P270-P405-P501

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Other Classifications

Building Blocks Skeleton Aromatic ring compounds Benzene compounds

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Benzothioamide

CAS No. 2227-79-4

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