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19076-56-3

19076-56-3 | 3-Furancarboxylic acid, 2-formyl-, ethyl ester

CAS No: 19076-56-3 Catalog No: AG002ERQ MDL No:

Product Description

Catalog Number:
AG002ERQ
Chemical Name:
3-Furancarboxylic acid, 2-formyl-, ethyl ester
CAS Number:
19076-56-3
Molecular Formula:
C8H8O4
Molecular Weight:
168.1467
IUPAC Name:
ethyl 2-formylfuran-3-carboxylate
InChI:
InChI=1S/C8H8O4/c1-2-11-8(10)6-3-4-12-7(6)5-9/h3-5H,2H2,1H3
InChI Key:
MOBPCMQBARMUHY-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1ccoc1C=O

Properties

Complexity:
178  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
168.042g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
168.148g/mol
Monoisotopic Mass:
168.042g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
56.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1  

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