Structure

4-Mercaptobutyric acid

CAS
13095-73-3
Catalog Number
ACM13095733
Category
Alkenes
Molecular Weight
120.17
Molecular Formula
C4H8O2S

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Specification

Synonyms
4-mercapto-butanoicaci;4-mercapto-butyricaci;gamma-mercaptobutyricacid;4-MERCAPTOBUTYRIC ACID;4-Thiobutyric Acid;4-Mercaptobutyric Acid Tech Grade;4-Mercaptobutanoic Acid;Butanoic acid, 4-Mercapto-
Boiling Point
128-129°C @11mm
Hazard Statements
Xi
Safety Description
26
Supplemental Hazard Statements
H315-H319
Symbol
GHS07
What is the PubChem CID of 4-Mercaptobutyric acid?

The PubChem CID of 4-Mercaptobutyric acid is 25700.

What is the molecular formula of 4-Mercaptobutyric acid?

The molecular formula of 4-Mercaptobutyric acid is C4H8O2S.

What is the molecular weight of 4-Mercaptobutyric acid?

The molecular weight of 4-Mercaptobutyric acid is 120.17 g/mol.

What is the IUPAC name of 4-Mercaptobutyric acid?

The IUPAC name of 4-Mercaptobutyric acid is 4-sulfanylbutanoic acid.

What is the InChI of 4-Mercaptobutyric acid?

The InChI of 4-Mercaptobutyric acid is InChI=1S/C4H8O2S/c5-4(6)2-1-3-7/h7H,1-3H2,(H,5,6).

What is the Canonical SMILES of 4-Mercaptobutyric acid?

The Canonical SMILES of 4-Mercaptobutyric acid is C(CC(=O)O)CS.

What is the CAS number of 4-Mercaptobutyric acid?

The CAS number of 4-Mercaptobutyric acid is 13095-73-3.

What is the XLogP3 value of 4-Mercaptobutyric acid?

The XLogP3 value of 4-Mercaptobutyric acid is 0.3.

How many hydrogen bond donor counts does 4-Mercaptobutyric acid have?

4-Mercaptobutyric acid has 2 hydrogen bond donor counts.

How many rotatable bond counts does 4-Mercaptobutyric acid have?

4-Mercaptobutyric acid has 3 rotatable bond counts.

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