1,1-Dimethylethyl (2S)-2-hydroxy-3-methylbutanoate

CAS Registry Number®

3519-30-0

CAS Name

1,1-Dimethylethyl (2S)-2-hydroxy-3-methylbutanoate

Molecular Formula

C9H18O3

Molecular Mass

174.24

Cite this Page

1,1-Dimethylethyl (2S)-2-hydroxy-3-methylbutanoate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=3519-30-0 (retrieved 2024-11-22) (CAS RN: 3519-30-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    61-63 °C @ Press: 1.8 Torr

  • Melting Point (1)

    30-31 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C9H18O3/c1-6(2)7(10)8(11)12-9(3,4)5/h6-7,10H,1-5H3/t7-/m0/s1

InChIKey

InChIKey=XQTIFSCLEWPKCF-ZETCQYMHSA-N

SMILES

C([C@H](C(C)C)O)(OC(C)(C)C)=O

Canonical SMILES

O=C(OC(C)(C)C)C(O)C(C)C

Other Names for this Substance

  • Butanoic acid, 2-hydroxy-3-methyl-, 1,1-dimethylethyl ester, (2S)-
  • Butyric acid, 2-hydroxy-3-methyl-, tert-butyl ester, L-
  • Butanoic acid, 2-hydroxy-3-methyl-, 1,1-dimethylethyl ester, (S)-
  • 1,1-Dimethylethyl (2S)-2-hydroxy-3-methylbutanoate
  • tert-Butyl L-α-hydroxyisovalerate

View All

CAS INSIGHTSTM
Targeted protein degrader structure, illustration