Home Halogens 1-(3-chloro-2-hydroxy-5-methylphenyl)ethan-1-one

1-(3-chloro-2-hydroxy-5-methylphenyl)ethan-1-one

CAS No.:
7507-88-2
Catalog Number:
AG01C82P
Molecular Formula:
C9H9ClO2
Molecular Weight:
184.6196
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Product Description
Catalog Number:
AG01C82P
Chemical Name:
1-(3-chloro-2-hydroxy-5-methylphenyl)ethan-1-one
CAS Number:
7507-88-2
Molecular Formula:
C9H9ClO2
Molecular Weight:
184.6196
MDL Number:
MFCD24714040
IUPAC Name:
1-(3-chloro-2-hydroxy-5-methylphenyl)ethanone
InChI:
InChI=1S/C9H9ClO2/c1-5-3-7(6(2)11)9(12)8(10)4-5/h3-4,12H,1-2H3
InChI Key:
XJSBYHFWKLPSOT-UHFFFAOYSA-N
SMILES:
Cc1cc(Cl)c(c(c1)C(=O)C)O
NSC Number:
401441
Properties
Complexity:
181  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
184.029g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
184.619g/mol
Monoisotopic Mass:
184.029g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  
Properties