Methyl 2-(2-cyanovinyl)benzoate

HCID 66818837
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Basic information

Standard SMILES
COC(=O)c1ccccc1C=CC#N
InChIKey
ZCENIYPLAMDGPF-UHFFFAOYSA-N
Molecular formula
C11H9NO2
Average molar mass
187.19 g/mol

Names & identifiers

Preferred name
Methyl 2-(2-cyanovinyl)benzoate
IUPAC
methyl 2-(2-cyanoethenyl)benzoate

Names & synonyms

SCHEMBL852020Methyl 2-(2-cyanovinyl)benzoateZCENIYPLAMDGPF-UHFFFAOYSA-N

Database identifiers

PubChem CID
66818837

Properties

Computed structural properties

XLogP
2.5
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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