Cas no 499242-88-5 (Pentanoic acid, 3-[[(1,1-dimethylethoxy)carbonyl]amino]-2,4-dimethyl-,methyl ester, (3S)-)

Pentanoic acid, 3-[[(1,1-dimethylethoxy)carbonyl]amino]-2,4-dimethyl-,methyl ester, (3S)- structure
499242-88-5 structure
Product Name:Pentanoic acid, 3-[[(1,1-dimethylethoxy)carbonyl]amino]-2,4-dimethyl-,methyl ester, (3S)-
CAS No:499242-88-5
MF:C13H25NO4
MW:259.341904401779
CID:1542087
Update Time:2024-08-23

Pentanoic acid, 3-[[(1,1-dimethylethoxy)carbonyl]amino]-2,4-dimethyl-,methyl ester, (3S)- Chemical and Physical Properties

Names and Identifiers

    • Pentanoic acid, 3-[[(1,1-dimethylethoxy)carbonyl]amino]-2,4-dimethyl-,methyl ester, (3S)-
    • Pentanoic acid, 3-[[(1,1-dimethylethoxy)carbonyl]amino]-2,4-dimethyl-, methyl ester, (3S)-
    • Inchi: 1S/C13H25NO4/c1-8(2)10(9(3)11(15)17-7)14-12(16)18-13(4,5)6/h8-10H,1-7H3,(H,14,16)/t9?,10-/m0/s1
    • InChI Key: LLIRGAMWGANOJB-AXDSSHIGSA-N
    • SMILES: C(OC)(=O)C(C)[C@@H](NC(OC(C)(C)C)=O)C(C)C

Computed Properties

  • Exact Mass: 259.17845

Experimental Properties

  • Density: 0.997±0.06 g/cm3(Predicted)
  • Boiling Point: 340.3±25.0 °C(Predicted)
  • PSA: 64.63
  • pka: 12.01±0.46(Predicted)
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