Home Other Building Blocks 1-(2,4-DIFLUORO-3-HYDROXYPHENYL)ETHANONE

1-(2,4-DIFLUORO-3-HYDROXYPHENYL)ETHANONE

CAS No.:
951163-65-8
Catalog Number:
AG01DWWL
Molecular Formula:
C8H6F2O2
Molecular Weight:
172.1288
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Product Description
Catalog Number:
AG01DWWL
Chemical Name:
1-(2,4-DIFLUORO-3-HYDROXYPHENYL)ETHANONE
CAS Number:
951163-65-8
Molecular Formula:
C8H6F2O2
Molecular Weight:
172.1288
MDL Number:
MFCD16619378
IUPAC Name:
1-(2,4-difluoro-3-hydroxyphenyl)ethanone
InChI:
InChI=1S/C8H6F2O2/c1-4(11)5-2-3-6(9)8(12)7(5)10/h2-3,12H,1H3
InChI Key:
MLLPYLDZFBDNON-UHFFFAOYSA-N
SMILES:
CC(=O)c1ccc(c(c1F)O)F
Properties
Complexity:
184  
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:
1  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  
Properties