Home Carboxys 7-Fluoro-2,3-dihydrobenzofuran-2-carboxylic acid

7-Fluoro-2,3-dihydrobenzofuran-2-carboxylic acid

CAS No.:
1354951-91-9
Catalog Number:
AG009YT6
Molecular Formula:
C9H7FO3
Molecular Weight:
182.1485
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Product Description
Catalog Number:
AG009YT6
Chemical Name:
7-Fluoro-2,3-dihydrobenzofuran-2-carboxylic acid
CAS Number:
1354951-91-9
Molecular Formula:
C9H7FO3
Molecular Weight:
182.1485
MDL Number:
MFCD20441595
IUPAC Name:
7-fluoro-2,3-dihydro-1-benzofuran-2-carboxylic acid
InChI:
InChI=1S/C9H7FO3/c10-6-3-1-2-5-4-7(9(11)12)13-8(5)6/h1-3,7H,4H2,(H,11,12)
InChI Key:
SWXYQTMGNFNTDC-UHFFFAOYSA-N
SMILES:
OC(=O)C1Cc2c(O1)c(F)ccc2
Properties
Complexity:
219  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
182.038g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
182.15g/mol
Monoisotopic Mass:
182.038g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Properties