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55552-70-0

55552-70-0 | 3-Furanboronic acid

CAS No: 55552-70-0 Catalog No: AG0033PS MDL No:MFCD01319007

Product Description

Catalog Number:
AG0033PS
Chemical Name:
3-Furanboronic acid
CAS Number:
55552-70-0
Molecular Formula:
C4H5BO3
Molecular Weight:
111.8917
MDL Number:
MFCD01319007
IUPAC Name:
furan-3-ylboronic acid
InChI:
InChI=1S/C4H5BO3/c6-5(7)4-1-2-8-3-4/h1-3,6-7H
InChI Key:
CYEFKCRAAGLNHW-UHFFFAOYSA-N
SMILES:
OB(c1cocc1)O

Properties

Complexity:
75.7  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
112.033g/mol
Formal Charge:
0
Heavy Atom Count:
8  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
111.891g/mol
Monoisotopic Mass:
112.033g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
53.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

Literature

Title Journal
Synthesis of 8-aryl-substituted coumarins based on ring-closing metathesis and Suzuki-Miyaura coupling: synthesis of a furyl coumarin natural product from Galipea panamensis. The Journal of organic chemistry 20120302

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