Home Other Building Blocks 2-Chloro-1-(3,5-dihydroxyphenyl)ethanone

2-Chloro-1-(3,5-dihydroxyphenyl)ethanone

CAS No.:
39878-43-8
Catalog Number:
AG01FNR3
Molecular Formula:
C8H7ClO3
Molecular Weight:
186.5924
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Product Description
Catalog Number:
AG01FNR3
Chemical Name:
2-Chloro-1-(3,5-dihydroxyphenyl)ethanone
CAS Number:
39878-43-8
Molecular Formula:
C8H7ClO3
Molecular Weight:
186.5924
MDL Number:
MFCD20624061
IUPAC Name:
2-chloro-1-(3,5-dihydroxyphenyl)ethanone
InChI:
InChI=1S/C8H7ClO3/c9-4-8(12)5-1-6(10)3-7(11)2-5/h1-3,10-11H,4H2
InChI Key:
ASZDQGFVJIMRRQ-UHFFFAOYSA-N
SMILES:
ClCC(=O)c1cc(O)cc(c1)O
Properties
Complexity:
162  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
186.008g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
186.591g/mol
Monoisotopic Mass:
186.008g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
57.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  
Properties