1,3-Propanediol, 1,3-dibenzoate

CAS Registry Number®

2451-86-7

CAS Name

1,3-Propanediol, 1,3-dibenzoate

Molecular Formula

C17H16O4

Molecular Mass

284.31

Cite this Page

1,3-Propanediol, 1,3-dibenzoate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=2451-86-7 (retrieved 2024-11-22) (CAS RN: 2451-86-7).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    60-61 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C17H16O4/c18-16(14-8-3-1-4-9-14)20-12-7-13-21-17(19)15-10-5-2-6-11-15/h1-6,8-11H,7,12-13H2

InChIKey

InChIKey=SSEOOCRUUJYCKA-UHFFFAOYSA-N

SMILES

C(OCCCOC(=O)C1=CC=CC=C1)(=O)C2=CC=CC=C2

Canonical SMILES

O=C(OCCCOC(=O)C=1C=CC=CC1)C=2C=CC=CC2

Other Names for this Substance

  • 1,3-Propanediol, 1,3-dibenzoate
  • 1,3-Propanediol, dibenzoate
  • Trimethylene benzoate
  • Trimethylene glycol dibenzoate
  • Trimethylene dibenzoate

View All

CAS INSIGHTSTM
Targeted protein degrader structure, illustration