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Structure

3-Amino-3-(thiophen-3-yl)propanoic acid

CAS
94333-62-7
Catalog Number
ACM94333627
Category
Other Products
Molecular Weight
171.22
Molecular Formula
C7H9NO2S

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What is the molecular weight of 3-Amino-3-(thiophen-3-yl)propanoic acid?

The molecular weight of 3-Amino-3-(thiophen-3-yl)propanoic acid is 171.22 g/mol.

What is the IUPAC name of the compound?

The IUPAC name of the compound is 3-amino-3-thiophen-3-ylpropanoic acid.

What is the Canonical SMILES of the compound?

The Canonical SMILES of the compound is C1=CSC=C1C(CC(=O)O)N.

What is the InChIKey of the compound?

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

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

There are 2 hydrogen bond donor counts in the compound.

What is the topological polar surface area of the compound?

The topological polar surface area of the compound is 91.6 Å^2.

Is the compound canonicalized?

Yes, the compound is canonicalized.

What is the XLogP3-AA value of the compound?

The XLogP3-AA value of the compound is -2.3.

How many rotatable bond counts are there in the compound?

There are 3 rotatable bond counts in the compound.

What is the defined atom stereocenter count of the compound?

The defined atom stereocenter count of the compound is 0.

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