Structure

3-Thiophenezoic acid

CAS
88-13-1
Catalog Number
ACM88131
Category
Thiophenes
Molecular Weight
128.15
Molecular Formula
C5H4O2S

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Specification

Synonyms
Thiophene-3-carboxylic acid;beta-Thiophenecarboxylic acid
Melting Point
136-141°C(lit.)
Appearance
Light Brown Solid
What is the molecular formula of 3-Thiophenezoic acid?

The molecular formula of 3-Thiophenezoic acid is C5H4O2S.

What is the molecular weight of 3-Thiophenezoic acid?

The molecular weight of 3-Thiophenezoic acid is 128.15 g/mol.

What is the IUPAC Name of 3-Thiophenezoic acid?

The IUPAC Name of 3-Thiophenezoic acid is thiophene-3-carboxylic acid.

What is the Canonical SMILES of 3-Thiophenezoic acid?

The Canonical SMILES of 3-Thiophenezoic acid is C1=CSC=C1C(=O)O.

Is 3-Thiophenezoic acid capable of forming hydrogen bonds?

Yes, 3-Thiophenezoic acid has a hydrogen bond donor count of 1 and a hydrogen bond acceptor count of 3.

What is the topological polar surface area of 3-Thiophenezoic acid?

The topological polar surface area of 3-Thiophenezoic acid is 65.5 Ų.

What is the XLogP3 value of 3-Thiophenezoic acid?

The XLogP3 value of 3-Thiophenezoic acid is 1.5.

How many rotatable bonds does 3-Thiophenezoic acid have?

3-Thiophenezoic acid has 1 rotatable bond.

Does 3-Thiophenezoic acid contain any defined atom stereocenters?

No, 3-Thiophenezoic acid does not contain any defined atom stereocenters.

What is the exact mass of 3-Thiophenezoic acid?

The exact mass of 3-Thiophenezoic acid is 127.99320054 g/mol.

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