2-Isopropoxy-5-(thiophen-2-yl)benzonitrile

HCID 58367285
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Basic information

Standard SMILES
CC(C)Oc1ccc(-c2cccs2)cc1C#N
InChIKey
LUWQEXMGFHUNIM-UHFFFAOYSA-N
Molecular formula
C14H13NOS
Average molar mass
243.33 g/mol

Names & identifiers

Preferred name
2-Isopropoxy-5-(thiophen-2-yl)benzonitrile
IUPAC
2-propan-2-yloxy-5-thiophen-2-ylbenzonitrile

Names & synonyms

SCHEMBL2167663LUWQEXMGFHUNIM-UHFFFAOYSA-N2-isopropoxy-5-(thiophen-2-yl)benzonitrile

Database identifiers

PubChem CID
58367285

Properties

Computed structural properties

XLogP
3.8
Topological polar surface area
61.3 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
3
Heavy atoms
17

Related reactions

2 records
New reaction record

Compound notes

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