5-Fluoro-2-(methylsulfonyl)benzoic acid

Catalog Number
ACMA00001904
Category
Aryl Fluorinated Building Blocks
Molecular Weight
218.20
Molecular Formula
C8H7FO3

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Specification

Hazard Statements
H315-H319-H335
RIDADR
NONH for all modes of transport
Symbol
GHS07
What is the molecular formula of the compound?

The molecular formula of the compound is C8H7FO4S.

What is the molecular weight of the compound?

The molecular weight of the compound is 218.20 g/mol.

What is the IUPAC name of the compound?

The IUPAC name of the compound is 5-fluoro-2-methylsulfonylbenzoic acid.

What is the InChIKey of the compound?

The InChIKey of the compound is UYODNSHQTPLEAS-UHFFFAOYSA-N.

How many hydrogen bond donor counts are there in the compound?

There is 1 hydrogen bond donor count in the compound.

How many hydrogen bond acceptor counts are there in the compound?

There are 5 hydrogen bond acceptor counts in the compound.

What is the topological polar surface area of the compound?

The topological polar surface area of the compound is 79.8 Å2.

How many rotatable bond counts are there in the compound?

There are 2 rotatable bond counts in the compound.

Is the compound canonicalized?

Yes, the compound is canonicalized.

What is the CAS number of the compound?

The CAS number of the compound is 773873-55-5.

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