5-(1-Cyanoethyl)-2-methoxybenzaldehyde

HCID 19066487
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Basic information

Standard SMILES
COc1ccc(C(C)C#N)cc1C=O
InChIKey
HNLSQFCBCQUMQU-UHFFFAOYSA-N
Molecular formula
C11H11NO2
Average molar mass
189.21 g/mol

Names & identifiers

Preferred name
5-(1-Cyanoethyl)-2-methoxybenzaldehyde
IUPAC
2-(3-formyl-4-methoxyphenyl)propanenitrile

Names & synonyms

SCHEMBL7583964HNLSQFCBCQUMQU-UHFFFAOYSA-N5-(1-Cyanoethyl)-2-methoxybenzaldehyde

Database identifiers

PubChem CID
19066487

Properties

Computed structural properties

XLogP
1.6
Topological polar surface area
50.1 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
3
Heavy atoms
14

Related reactions

4 records
New reaction record

Compound notes

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