Home Halogens 1-(3,4-dichloro-2-hydroxyphenyl)propan-1-one

1-(3,4-dichloro-2-hydroxyphenyl)propan-1-one

CAS No.:
777067-72-8
Catalog Number:
AG01AB38
Molecular Formula:
C9H8Cl2O2
Molecular Weight:
219.0646
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Product Description
Catalog Number:
AG01AB38
Chemical Name:
1-(3,4-dichloro-2-hydroxyphenyl)propan-1-one
CAS Number:
777067-72-8
Molecular Formula:
C9H8Cl2O2
Molecular Weight:
219.0646
MDL Number:
MFCD17977049
IUPAC Name:
1-(3,4-dichloro-2-hydroxyphenyl)propan-1-one
InChI:
InChI=1S/C9H8Cl2O2/c1-2-7(12)5-3-4-6(10)8(11)9(5)13/h3-4,13H,2H2,1H3
InChI Key:
GTXATAAOUWENOM-UHFFFAOYSA-N
SMILES:
CCC(=O)c1ccc(c(c1O)Cl)Cl
Properties
Complexity:
196  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
217.99g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
219.061g/mol
Monoisotopic Mass:
217.99g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8  
Properties