2-Heptyl acetate

CAS Registry Number®

5921-82-4

CAS Name

2-Heptyl acetate

Molecular Formula

C9H18O2

Molecular Mass

158.24

Cite this Page

2-Heptyl acetate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=5921-82-4 (retrieved 2024-11-01) (CAS RN: 5921-82-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    171-173 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C9H18O2/c1-4-5-6-7-8(2)11-9(3)10/h8H,4-7H2,1-3H3

InChIKey

InChIKey=VJYWBLDDQZIGJI-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

O=C(OC(C)CCCCC)C

Other Names for this Substance

  • 2-Heptanol, 2-acetate
  • 2-Heptanol, acetate
  • 1-Methylhexyl acetate
  • 2-Heptyl acetate
  • Hept-2-yl ethanoate

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Deleted or Replaced CAS Registry Numbers

145840-85-3

CAS INSIGHTSTM
Adam Sanford and Orr Ravitz from CAS