Home Other Building Blocks 3-ethyl-2,5-dihydrofuran-2,5-dione

3-ethyl-2,5-dihydrofuran-2,5-dione

CAS No.:
14156-13-9
Catalog Number:
AG01DYQI
Molecular Formula:
C6H6O3
Molecular Weight:
126.1100
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Product Description
Catalog Number:
AG01DYQI
Chemical Name:
3-ethyl-2,5-dihydrofuran-2,5-dione
CAS Number:
14156-13-9
Molecular Formula:
C6H6O3
Molecular Weight:
126.1100
MDL Number:
MFCD29919501
IUPAC Name:
3-ethylfuran-2,5-dione
InChI:
InChI=1S/C6H6O3/c1-2-4-3-5(7)9-6(4)8/h3H,2H2,1H3
InChI Key:
AXGOOCLYBPQWNG-UHFFFAOYSA-N
SMILES:
CCC1=CC(=O)OC1=O
Properties
Complexity:
191  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
126.032g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
126.111g/mol
Monoisotopic Mass:
126.032g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
43.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7  
Literature
Title Journal
Gas-to-particle conversion in surface discharge nonthermal plasmas and its implications for atmospheric chemistry. Sensors (Basel, Switzerland) 20110101
Properties