Home Other Building Blocks 7-BROMO-6-FLUOROCHROMAN-4-ONE

7-BROMO-6-FLUOROCHROMAN-4-ONE

CAS No.:
27407-12-1
Catalog Number:
AG01DU53
Molecular Formula:
C9H6BrFO2
Molecular Weight:
245.0451
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Product Description
Catalog Number:
AG01DU53
Chemical Name:
7-BROMO-6-FLUOROCHROMAN-4-ONE
CAS Number:
27407-12-1
Molecular Formula:
C9H6BrFO2
Molecular Weight:
245.0451
MDL Number:
MFCD18648382
IUPAC Name:
7-bromo-6-fluoro-2,3-dihydrochromen-4-one
InChI:
InChI=1S/C9H6BrFO2/c10-6-4-9-5(3-7(6)11)8(12)1-2-13-9/h3-4H,1-2H2
InChI Key:
GJIKUJVFHWCVKW-UHFFFAOYSA-N
SMILES:
O=C1CCOc2c1cc(F)c(c2)Br
Properties
Complexity:
222  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
243.954g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
245.047g/mol
Monoisotopic Mass:
243.954g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  
Properties