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3-(hydroxymethyl)-5-methyl-heptanoic acid

3-(hydroxymethyl)-5-methyl-heptanoic acid

Systemtic Name:3-(hydroxymethyl)-5-methyl-heptanoic acid
Openeye Name:3-(hydroxymethyl)-5-methyl-heptanoic acid
CAS Name:3-(hydroxymethyl)-5-methylheptanoic acid
IUPAC Name:3-(hydroxymethyl)-5-methylheptanoic acid
Traditional Name:5-methyl-3-methylol-enanthic acid
Formula: C9H18O3
MolecularWeight: 174.23742
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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)CC(CC(=O)O)CO


Isomeric SMILES

CCC(C)CC(CC(=O)O)CO


InChI

InChI=1S/C9H18O3/c1-3-7(2)4-8(6-10)5-9(11)12/h7-8,10H,3-6H2,1-2H3,(H,11,12)


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