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Structure

5-Chloro-2-(4-methoxyphenyl)benzo[d]thiazole

CAS
92161-46-1
Catalog Number
ACM92161461
Category
Other Products
Molecular Weight
275.75
Molecular Formula
C14H10ClNOS

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Specification

Synonyms
5-CHLORO-2-(4-METHOXYPHENYL)BENZO[D]THIAZOLE
What is the molecular formula of the compound in PubChem CID 15500404?

The molecular formula is C14H10ClNOS.

What is the IUPAC name of the compound?

The IUPAC name is 5-chloro-2-(4-methoxyphenyl)-1,3-benzothiazole.

What is the molecular weight of the compound?

The molecular weight is 275.8 g/mol.

What is the Canonical SMILES notation for the compound?

The Canonical SMILES notation is COC1=CC=C(C=C1)C2=NC3=C(S2)C=CC(=C3)Cl.

What is the InChIKey of the compound?

The InChIKey is WWTPXFOVXNWHQY-UHFFFAOYSA-N.

What is the CAS number of the compound?

The CAS number is 92161-46-1.

What is the XLogP3 value of the compound?

The XLogP3 value is 4.9.

How many hydrogen bond donor counts does the compound have?

The compound has 0 hydrogen bond donor counts.

What is the topological polar surface area of the compound?

The topological polar surface area is 50.4 A^2.

Is the compound canonicalized?

Yes, the compound is canonicalized according to PubChem.

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