Furfural Impurity 3

CAT: 1596-AR-F11088-01Size: 10 UnitsDry Ice: NoHazardous: No

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CAT#:1596-AR-F11088-01Size:10 Units

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CAS Number

7389-38-0

Molecular Formula

C12H10O5

Molecular Weight

234.053

API Name

Furfural

Chemical Information

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

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

CAS Number	7389-38-0
PubChem CID	12366272
IUPAC Name	5-[(5-formylfuran-2-yl)methoxymethyl]furan-2-carbaldehyde
Molecular Formula	C12H10O5
Molecular Weight	234.20
XLogP	0.9
Topological Polar Surface Area	69.7
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	6
Heavy Atom Count	17
Formal Charge	0
Complexity	242

SMILES

C1=C(OC(=C1)C=O)COCC2=CC=C(O2)C=O

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

InChIKey

TZTWOBUHCLWLNK-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 7389-38-0

CID: 12366272

Formula: C12H10O5

MW: 234.20

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	234.20
XLogP3	0.9
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	6
Exact Mass	234.05282342
Monoisotopic Mass	234.05282342
Topological Polar Surface Area	69.7 Å²
Heavy Atom Count	17
Formal Charge	0
Complexity	242
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
AR-F11086-01	Furfural Impurity 6
AR-F11089-01	Furfural Impurity 4
AR-F11087-01	Furfural Impurity 7
AR-F11085-01	Furfural Impurity 5
AR-F11091-01	3-Hydroxy Furfural
AR-F02208-01	Furfural
AR-F02209-01	5-Hydroxymethyl Furfural
AR-F11090-01	Sulfoxymethyl-Furfural Sodium Salt
AR-N01599-01	Nintedanib Impurity 3 (Intedanib Impurity 3)
AR-L06889-01	Letermovir Impurity 3

Catalog	Name
RM-F212128-01	Furfural Impurity 1
RM-F212129-01	Furfural Impurity 2
RM-F212127-01	5-Hydroxymethyl Furfural; Glucosamine Hydrochloride EP Impurity E
MBS3610292	Furfural
164251	Furfural-d4
47462-01	Furfural pure, 99%
268415-01	5- (Chloromethyl) furfural
16603733	5- (Hydroxymethyl) furfural
M6820-01	5-Methyl furfural
C369220	5-(Chloromethyl)furfural