Cas no 98061-13-3 (Propanedioic acid, heptylmethyl-, monomethyl ester, (R)-)

Propanedioic acid, heptylmethyl-, monomethyl ester, (R)- structure
98061-13-3 structure
Product Name:Propanedioic acid, heptylmethyl-, monomethyl ester, (R)-
CAS No:98061-13-3
MF:C12H22O4
MW:230.300684452057
CID:750760
Update Time:2024-01-31

Propanedioic acid, heptylmethyl-, monomethyl ester, (R)- Chemical and Physical Properties

Names and Identifiers

    • Propanedioic acid, heptylmethyl-, monomethyl ester, (R)-
    • Propanedioic acid, 2-heptyl-2-methyl-, 1-methyl ester, (2R)-
    • Inchi: 1S/C12H22O4/c1-4-5-6-7-8-9-12(2,10(13)14)11(15)16-3/h4-9H2,1-3H3,(H,13,14)/t12-/m1/s1
    • InChI Key: WVGHCRMWGJXOGB-GFCCVEGCSA-N
    • SMILES: C(OC)(=O)[C@@](CCCCCCC)(C)C(O)=O

Experimental Properties

  • Density: 1.024±0.06 g/cm3(Predicted)
  • Boiling Point: 331.9±25.0 °C(Predicted)
  • pka: 3.59±0.41(Predicted)
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