CAS
199189-67-8 Purity
96%
199189-67-8 Purity
96%
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3-[(4-Formylphenoxy)methyl]thiophene-2-carbonitrile
CAS
256471-05-3
Catalog Number
ACM256471053
Category
Other Products
Molecular Weight
243.29
Molecular Formula
C13H9NO2S
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What is the molecular formula of the compound with PubChem CID 2797328?
The molecular formula is C13H9NO2S.
When was the compound with PubChem CID 2797328 created and last modified?
It was created on 2005-07-19 and last modified on 2023-12-30.
What is the IUPAC name of the compound with PubChem CID 2797328?
The IUPAC name is 3-[(4-formylphenoxy)methyl]thiophene-2-carbonitrile.
What is the InChI of the compound with PubChem CID 2797328?
The InChI is InChI=1S/C13H9NO2S/c14-7-13-11(5-6-17-13)9-16-12-3-1-10(8-15)2-4-12/h1-6,8H,9H2.
What is the Canonical SMILES of the compound with PubChem CID 2797328?
The Canonical SMILES is C1=CC(=CC=C1C=O)OCC2=C(SC=C2)C#N.
What is the molecular weight of the compound with PubChem CID 2797328?
The molecular weight is 243.28 g/mol.
What is the XLogP3-AA value of the compound with PubChem CID 2797328?
The XLogP3-AA value is 2.6.
How many hydrogen bond donor counts does the compound with PubChem CID 2797328 have?
It has 0 hydrogen bond donor counts.
What is the topological polar surface area of the compound with PubChem CID 2797328?
The topological polar surface area is 78.3 Ų.
Is the compound with PubChem CID 2797328 canonicalized?
Yes, the compound is canonicalized according to PubChem.
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