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Structure

2-Chloro-4-methylthieno[3,4-b]pyridine

CAS
952435-07-3
Catalog Number
ACM952435073
Category
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What is the molecular formula of 2-Chloro-4-methylthieno[3,4-b]pyridine?

The molecular formula is C8H6ClNS.

What is the molecular weight of 2-Chloro-4-methylthieno[3,4-b]pyridine?

The molecular weight is 183.66 g/mol.

What is the IUPAC name of 2-Chloro-4-methylthieno[3,4-b]pyridine?

The IUPAC name is 2-chloro-4-methylthieno[3,4-b]pyridine.

What is the InChI of 2-Chloro-4-methylthieno[3,4-b]pyridine?

The InChI is InChI=1S/C8H6ClNS/c1-5-2-8(9)10-7-4-11-3-6(5)7/h2-4H,1H3.

What is the InChIKey of 2-Chloro-4-methylthieno[3,4-b]pyridine?

The InChIKey is KNYRJDJCSDZOBL-UHFFFAOYSA-N.

What is the canonical SMILES of 2-Chloro-4-methylthieno[3,4-b]pyridine?

The canonical SMILES is CC1=CC(=NC2=CSC=C12)Cl.

What is the XLogP3-AA value of 2-Chloro-4-methylthieno[3,4-b]pyridine?

The XLogP3-AA value is 3.2.

How many hydrogen bond donor counts are there in 2-Chloro-4-methylthieno[3,4-b]pyridine?

There are 0 hydrogen bond donor counts.

How many hydrogen bond acceptor counts are there in 2-Chloro-4-methylthieno[3,4-b]pyridine?

There are 2 hydrogen bond acceptor counts.

What is the topological polar surface area of 2-Chloro-4-methylthieno[3,4-b]pyridine?

The topological polar surface area is 41.1 ?2.

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