4-Benzylisothiazole 98

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Catalog Number

ACM36412267

Product Name

Structure

CAS

36412-26-7

Category

Heterocyclic Organic Compound

Synonyms

Isothiazole,4-(phenylmethyl)-, CID142078, InChI=1/C10H9NS/c1-2-4-9(5-3-1)6-10-7-11-12-8-10/h1-5,7-8H,6H, 36412-26-7

IUPAC Name

4-benzyl-1,2-thiazole

Molecular Weight

175.25016

Molecular Formula

C₁₀H₉NS

Canonical SMILES

C1=CC=C(C=C1)CC2=CSN=C2

InChI Key

YEPBKWKFFVWMDX-UHFFFAOYSA-N

Boiling Point

203.4ºC at 760mmHg

Flash Point

69.5ºC

Density

1.157

Exact Mass

175.04600

Hazard Statements

Xi: Irritant;

H-Bond Acceptor

H-Bond Donor

Safety Description

26-37/39

MSDS

COA

Spec Sheet

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