Home Other Building Blocks 6-fluoro-7-hydroxy-3,4-dihydro-2H-1-benzopyran-4-one

6-fluoro-7-hydroxy-3,4-dihydro-2H-1-benzopyran-4-one

CAS No.:
178374-98-6
Catalog Number:
AG01BDWS
Molecular Formula:
C9H7FO3
Molecular Weight:
182.1485
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Product Description
Catalog Number:
AG01BDWS
Chemical Name:
6-fluoro-7-hydroxy-3,4-dihydro-2H-1-benzopyran-4-one
CAS Number:
178374-98-6
Molecular Formula:
C9H7FO3
Molecular Weight:
182.1485
MDL Number:
MFCD18648509
IUPAC Name:
6-fluoro-7-hydroxy-2,3-dihydrochromen-4-one
InChI:
InChI=1S/C9H7FO3/c10-6-3-5-7(11)1-2-13-9(5)4-8(6)12/h3-4,12H,1-2H2
InChI Key:
KCZDEYYVIJOTEC-UHFFFAOYSA-N
SMILES:
O=C1CCOc2c1cc(F)c(c2)O
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:
0
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1  
Properties