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1-(4-Chloro-3-nitrobenzenesulfonyl)-1,2,3,4-tetrahydroquinoline

CAS
947170-51-8
Catalog Number
ACM947170518
Category
Other Products
Molecular Formula
C15H13ClN2O4S

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What is the molecular formula of the compound with PubChem CID 7938498?

The molecular formula is C15H13ClN2O4S.

Can you provide the IUPAC name of the compound?

The IUPAC name is 1-(4-chloro-3-nitrophenyl)sulfonyl-3,4-dihydro-2H-quinoline.

What is the molecular weight of the compound?

The molecular weight is 352.8 g/mol.

What are some synonyms of the compound?

Synonyms include 1-(4-chloro-3-nitrobenzenesulfonyl)-1,2,3,4-tetrahydroquinoline and others listed in the reference.

What is the InChIKey of the compound?

The InChIKey is LEQSFEFOQFAWKA-UHFFFAOYSA-N.

How many hydrogen bond acceptors are there in the compound?

There are 5 hydrogen bond acceptors.

Is the compound's formal charge 0?

Yes, the formal charge is 0.

How many rotatable bond counts does the compound have?

There are 2 rotatable bond counts.

What is the topological polar surface area of the compound?

The topological polar surface area is 91.6?2.

Is the compound canonicalized?

Yes, the compound is canonicalized.

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