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heptane hydrate

heptane hydrate

Systemtic Name:heptane hydrate
Openeye Name:heptane hydrate
CAS Name:heptane hydrate
IUPAC Name:heptane hydrate
Traditional Name:n-heptane hydrate
Formula: C14H34O
MolecularWeight: 218.41916
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC.CCCCCCC.O


Isomeric SMILES

CCCCCCC.CCCCCCC.O


InChI

InChI=1S/2C7H16.H2O/c2*1-3-5-7-6-4-2;/h2*3-7H2,1-2H3;1H2


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