Hexylbenzene

CAS Registry Number®

1077-16-3

CAS Name

Hexylbenzene

Molecular Formula

C12H18

Molecular Mass

162.27

Cite this Page

Hexylbenzene.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=1077-16-3 (retrieved 2024-12-06) (CAS RN: 1077-16-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    226.1 °C
  • Melting Point (1)

    -61 °C
  • Density (2)

    0.852 g/cm³ @ Temp: 19 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C12H18/c1-2-3-4-6-9-12-10-7-5-8-11-12/h5,7-8,10-11H,2-4,6,9H2,1H3

InChIKey

InChIKey=LTEQMZWBSYACLV-UHFFFAOYSA-N

SMILES

C(CCCCC)C1=CC=CC=C1

Canonical SMILES

C=1C=CC(=CC1)CCCCCC

Other Names for this Substance

  • Benzene, hexyl-
  • Hexane, 1-phenyl-
  • Hexylbenzene
  • n-Hexylbenzene
  • 1-Phenylhexane

Deleted or Replaced CAS Registry Numbers

74296-34-7

CAS INSIGHTSTM
Abstract molecules design, Atoms, Medical background