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disodium 3-propylphthalate

disodium 3-propylphthalate

Systemtic Name:disodium 3-propylphthalate
Openeye Name:disodium 3-propylphthalate
CAS Name:disodium 3-propylphthalate
IUPAC Name:disodium 3-propylphthalate
Traditional Name:disodium 3-propylphthalate
Formula: C11H10Na2O4
MolecularWeight: 252.17424
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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=CC(=C1C(=O)[O-])C(=O)[O-].[Na+].[Na+]


Isomeric SMILES

CCCC1=CC=CC(=C1C(=O)[O-])C(=O)[O-].[Na+].[Na+]


InChI

InChI=1S/C11H12O4.2Na/c1-2-4-7-5-3-6-8(10(12)13)9(7)11(14)15;;/h3,5-6H,2,4H2,1H3,(H,12,13)(H,14,15);;/q;2*+1/p-2


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