2-PROPENOIC ACID, SODIUM SALT (1:1)

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Keyword(s): Food Contact Chemicals
Molecule Category Salt-form
UNII 7C98FKB43H
EPA CompTox DTXSID4027652

Structure

InChI Key NNMHYFLPFNGQFZ-UHFFFAOYSA-M
Smiles [Na+].[O-]C(=O)C=C
InChI
InChI=1S/C3H4O2.Na/c1-2-3(4)5;/h2H,1H2,(H,4,5);/q;+1/p-1

Physicochemical Descriptors

Property Name Value
Molecular Formula C3H3NaO2
Molecular Weight 94.0
AlogP -4.07
Hydrogen Bond Acceptor 2.0
Number of Rotational Bond 1.0
Polar Surface Area 40.13
Heavy Atoms 6.0

Cross References

Resources Reference
CAS NUMBER 7446-81-3
NORMAN SUSDAT
FDA SRS 7C98FKB43H
CONTENTS