1,3-Propanediol, 1,3-dibenzoate
CAS Registry Number®
2451-86-7
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CAS Name
1,3-Propanediol, 1,3-dibenzoateMolecular Formula
C17H16O4Molecular Mass
284.31Cite 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 ) (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
