Home Carboxys [2,2'-Bifuran]-5-carboxylic acid

[2,2'-Bifuran]-5-carboxylic acid

CAS No.:
856122-70-8
Catalog Number:
AG008HA3
Molecular Formula:
C9H6O4
Molecular Weight:
178.1415
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Product Description
Catalog Number:
AG008HA3
Chemical Name:
[2,2'-Bifuran]-5-carboxylic acid
CAS Number:
856122-70-8
Molecular Formula:
C9H6O4
Molecular Weight:
178.1415
MDL Number:
MFCD06802507
IUPAC Name:
5-(furan-2-yl)furan-2-carboxylic acid
InChI:
InChI=1S/C9H6O4/c10-9(11)8-4-3-7(13-8)6-2-1-5-12-6/h1-5H,(H,10,11)
InChI Key:
LSHBJDUGWLRJNU-UHFFFAOYSA-N
SMILES:
OC(=O)c1ccc(o1)c1ccco1
Properties
Complexity:
204  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
178.027g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
178.143g/mol
Monoisotopic Mass:
178.027g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
63.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  
Properties