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potassium 3-phenylpropanoate

Compound number:
MolPort-016-853-388
CAS number: 55322-48-0
IUPAC:
potassium 3-phenylpropanoate
IUPAC traditional:
potassium β-phenylpropionate
SMILES:
[K+].[O-]C(=O)CCc1ccccc1
InChI key:
DPAGNRMJGYANDY-UHFFFAOYSA-M
Molecular formula: C9H9KO2
Molecular weight: 188.267

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Compound Identifiers
Compound number: MolPort-016-853-388
CAS number: 55322-48-0

Names, Synonyms and 3rd Party Identifiers
Name: ZINC000000154564
3-phenylpropionic acid, potassium salt

InChI
InChI: 1S/C9H10O2.K/c10-9(11)7-6-8-4-2-1-3-5-8;/h1-5H,6-7H2,(H,10,11);/q;+1/p-1
InChI key: DPAGNRMJGYANDY-UHFFFAOYSA-M

Calculated Properties
Molecular formula: C9H9KO2
Molecular weight: 188.267

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2018 MolPort, v2.61, release date 09-11-2018 09:00 (+0200). All rights reserved.
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