5,5'-Oxybis(5-methylene-2-furaldehyde)

HCID 12366272CAS 7389-38-0
Substructure searchFind similar structures

Basic information

Standard SMILES
O=Cc1ccc(COCc2ccc(C=O)o2)o1
InChIKey
TZTWOBUHCLWLNK-UHFFFAOYSA-N
Molecular formula
C12H10O5
Average molar mass
234.2 g/mol
Monoisotopic mass
234.05282342

Overview

5,5'-Oxybis(5-methylene-2-furaldehyde) has been reported in Crataegus pinnatifida, Citrus reticulata, and other organisms with data available.

Names & identifiers

Preferred name
5,5'-Oxybis(5-methylene-2-furaldehyde)
IUPAC
5-[(5-formylfuran-2-yl)methoxymethyl]furan-2-carbaldehyde
English name
5,5'-oxybis(5-methylene-2-furaldehyde)
Molecular formula
C12H10O5
Molecular weight
234.21

Names & synonyms

7389-38-05,5'-Oxybis(5-methylene-2-furaldehyde)O-Bisme-furaldehydeDTXSID902244705-[(5-formylfuran-2-yl)methoxymethyl]furan-2-carbaldehyde5-((5-formylfuran-2-yl)methoxymethyl)furan-2-carbaldehydeRefChem:101023DTXCID90146961Cirsiumaldehyde5,5'-(Oxybis(methylene))bis(furan-2-carbaldehyde)5,5'-oxydimethylenebis(2-furfural)bis(5-formylfurfuryl)ether
Show more names
Furfural Impurity 3Bis - (5-formylfuryl) ether5,5’-oxydimethylenebis(2-furfural)5,5′-oxydimethylenebis(2-furfural)Bis-(5-Formylfurfuryl) Ether - (OBMF)5,5'（Oxy-bis(methylene))bis-2-furfural5, 5'(oxy-bis(methylene))bis-2-furfural
SCHEMBL278333MFCD001968485-{[(5-FORMYLFURAN-2-YL)METHOXY]METHYL}FURAN-2-CARBALDEHYDEAKOS04orb1680002orb2900218TN6975AKOS040763759

Database identifiers

CAS
7389-38-0
PubChem CID
12366272
DTXSID
DTXSID90224470
Nikkaji
J358.087C

Properties

Computed structural properties

XLogP
0.9
Topological polar surface area
69.7 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
5
Rotatable bonds
6
Heavy atoms
17

Physicochemical properties

Melting point
113.5 · 113.5-115.5 °C
Boiling point
404.8 · 404.8±45.0 °C(Predicted)
Density
1.313 · 1.313±0.06 g/cm3(Predicted)
form
Solid
color
Light brown to brown
InChI
InChI=1S/C12H10O5/c13-5-9-1-3-11(16-9)7-15-8-12-4-2-10(6-14)17-12/h1-6H,7-8H2

Safety & regulation

Safety data

Signal word
Warning
Symbol(GHS)
GHS07
Hazard statements
H315-H319
Precautionary statements
P264-P280-P302+P352-P337+P313-P305+P351+P338-P362+P364-P332+P313

Chemistry & industry

Applications

UsesCirsiumaldehyde is a useful research chemical compound.

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