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Isoxazole,5-(5-bromo-4-methyl-2-thienyl)-

CAS
945392-05-2
Catalog Number
ACM945392052
Category
Other Products
Molecular Formula
C8H6 Br N O S

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What is the molecular formula of 5-(5-bromo-4-methylthiophen-2-yl)-1,2-oxazole?

The molecular formula is C8H6BrNOS.

When was this compound created in PubChem?

It was created on October 30, 2011.

What is the InChIKey of this compound?

The InChIKey is YQBFLJQXISSAEQ-UHFFFAOYSA-N.

What is the XLogP3-AA value of this compound?

The XLogP3-AA value is 3.1.

How many hydrogen bond acceptors does this compound have?

It has 3 hydrogen bond acceptors.

What is the exact mass of this compound?

The exact mass is 242.93535 g/mol.

Does this compound have any defined atom stereocenter count?

No, it has 0 defined atom stereocenter count.

What is the topological polar surface area of this compound?

The topological polar surface area is 54.3 Ų.

How many rotatable bond counts does this compound have?

It has 1 rotatable bond count.

Is the compound canonicalized?

Yes, the compound is canonicalized.

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