Home Aldehydes 2,5-dimethylfuran-3-carbaldehyde

2,5-dimethylfuran-3-carbaldehyde

CAS No.:
54583-69-6
Catalog Number:
AG01A3VU
Molecular Formula:
C7H8O2
Molecular Weight:
124.1372
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Product Description
Catalog Number:
AG01A3VU
Chemical Name:
2,5-dimethylfuran-3-carbaldehyde
CAS Number:
54583-69-6
Molecular Formula:
C7H8O2
Molecular Weight:
124.1372
MDL Number:
MFCD04403314
IUPAC Name:
2,5-dimethylfuran-3-carbaldehyde
InChI:
InChI=1S/C7H8O2/c1-5-3-7(4-8)6(2)9-5/h3-4H,1-2H3
InChI Key:
RIMWBHRVGAHGNE-UHFFFAOYSA-N
SMILES:
O=Cc1cc(oc1C)C
Properties
Complexity:
112  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
124.052g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
124.139g/mol
Monoisotopic Mass:
124.052g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
30.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  
Properties