Home Other Building Blocks 1-(2,6-difluorophenyl)-2-hydroxyethan-1-one

1-(2,6-difluorophenyl)-2-hydroxyethan-1-one

CAS No.:
1250656-10-0
Catalog Number:
AG01BTFW
Molecular Formula:
C8H6F2O2
Molecular Weight:
172.1288
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Product Description
Catalog Number:
AG01BTFW
Chemical Name:
1-(2,6-difluorophenyl)-2-hydroxyethan-1-one
CAS Number:
1250656-10-0
Molecular Formula:
C8H6F2O2
Molecular Weight:
172.1288
MDL Number:
MFCD16165833
IUPAC Name:
1-(2,6-difluorophenyl)-2-hydroxyethanone
InChI:
InChI=1S/C8H6F2O2/c9-5-2-1-3-6(10)8(5)7(12)4-11/h1-3,11H,4H2
InChI Key:
BCVRWMGPLHANSR-UHFFFAOYSA-N
SMILES:
OCC(=O)c1c(F)cccc1F
Properties
Complexity:
162  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
172.034g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
172.131g/mol
Monoisotopic Mass:
172.034g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  
Properties