Cas no 24323-38-4 (ethyl 2-hydroxy-3-methylpentanoate)

ethyl 2-hydroxy-3-methylpentanoate structure
24323-38-4 structure
Product Name:ethyl 2-hydroxy-3-methylpentanoate
CAS No:24323-38-4
MF:C8H16O3
MW:160.210843086243
CID:1417254
PubChem ID:13026600
Update Time:2025-04-20

ethyl 2-hydroxy-3-methylpentanoate Chemical and Physical Properties

Names and Identifiers

    • ethyl 2-hydroxy-3-methylpentanoate
    • pentanoic acid, 2-hydroxy-3-methyl-, ethyl ester
    • LogP
    • 2-Hydroxy-3-methylpentanoic acid ethyl ester
    • CHEBI:173698
    • DTXSID50947158
    • Q27274340
    • (+/-)-Ethyl 2-hydroxy-3-methylvalerate [FIFH]
    • B476ID66GF
    • Valeric acid, 2-hydroxy-3-methyl-, ethyl ester
    • (+/-)-ETHYL 2-HYDROXY-3-METHYLVALERATE [FHFI]
    • AKOS011496933
    • LMFA07010694
    • FEMA No. 4269
    • SCHEMBL8065451
    • 24323-38-4
    • Ethyl 2-(d)-hydroxy-3-methylpentanoate
    • Ethyl2-hydroxy-3-methylpentanoate
    • (+/-)-Ethyl 2-hydroxy-3-methylvalerate
    • (2r,4s)-ethyl-2-hydroxy-3-methylpentanoate
    • TXLBCYISDOYPIH-UHFFFAOYSA-N
    • Ethyl 2-hydroxy-3-methylvalerate, (+/-)-
    • ETHYL 2-HYDROXY-3-METHYLVALERATE
    • UNII-B476ID66GF
    • Inchi: 1S/C8H16O3/c1-4-6(3)7(9)8(10)11-5-2/h6-7,9H,4-5H2,1-3H3
    • InChI Key: TXLBCYISDOYPIH-UHFFFAOYSA-N
    • SMILES: OC(C(=O)OCC)C(C)CC

Computed Properties

  • Exact Mass: 160.10998
  • Monoisotopic Mass: 160.109944368g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 11
  • Rotatable Bond Count: 5
  • Complexity: 123
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 2
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 1.6
  • Topological Polar Surface Area: 46.5?2

Experimental Properties

  • Density: 0.986
  • Boiling Point: 197 oC
  • Flash Point: 74 oC
  • PSA: 46.53
  • FEMA: 4269 | (+/-)-ETHYL 2-HYDROXY-3-METHYLVALERATE
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