Acetylene benzoic acid

HCID 68634872
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Basic information

Standard SMILES
C#C.O=C(O)c1ccccc1
InChIKey
JEKQWTHOOMAFFN-UHFFFAOYSA-N
Molecular formula
C9H8O2
Average molar mass
148.16 g/mol

Names & identifiers

Preferred name
Acetylene benzoic acid
IUPAC
acetylene;benzoic acid

Names & synonyms

acetylene benzoic acidSCHEMBL3417918JEKQWTHOOMAFFN-UHFFFAOYSA-N

Database identifiers

PubChem CID
68634872

Properties

Computed structural properties

Topological polar surface area
37.3 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
1
Heavy atoms
11

Related reactions

1 records
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Compound notes

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