rel-(4R,7S)-4-Methyl-7-(1-methylethyl)-2-oxepanone

CAS Registry Number®

130981-75-8
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CAS Name

rel-(4R,7S)-4-Methyl-7-(1-methylethyl)-2-oxepanone

Molecular Formula

C10H18O2

Molecular Mass

170.25

Cite this Page

rel-(4R,7S)-4-Methyl-7-(1-methylethyl)-2-oxepanone.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=130981-75-8 (retrieved 2024-09-08) (CAS RN: 130981-75-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1/C10H18O2/c1-7(2)9-5-4-8(3)6-10(11)12-9/h7-9H,4-6H2,1-3H3/t8-,9+/s2

InChIKey

InChIKey=GGAXPLCKKANQED-BRJQIKQINA-N

SMILES

[C@H](C)(C)[C@H]1OC(=O)C[C@H](C)CC1

Canonical SMILES

O=C1OC(CCC(C)C1)C(C)C

Other Names for this Substance

  • 2-Oxepanone, 4-methyl-7-(1-methylethyl)-, (4R,7S)-rel-
  • 2-Oxepanone, 4-methyl-7-(1-methylethyl)-, trans-
  • rel-(4R,7S)-4-Methyl-7-(1-methylethyl)-2-oxepanone

Deleted or Replaced CAS Registry Numbers

133162-66-0