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Home Halogens Ethyl 3,5-dichloro-4-hydroxybenzoate

Ethyl 3,5-dichloro-4-hydroxybenzoate

CAS No.:
17302-82-8
Catalog Number:
AG003Q6N
Molecular Formula:
C9H8Cl2O3
Molecular Weight:
235.0640
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5g
>98.0%(GC)(T)
1 week
United States
$89
- +
25g
>98.0%(GC)(T)
1 week
United States
$194
- +
Product Description
Catalog Number:
AG003Q6N
Chemical Name:
Ethyl 3,5-dichloro-4-hydroxybenzoate
CAS Number:
17302-82-8
Molecular Formula:
C9H8Cl2O3
Molecular Weight:
235.0640
MDL Number:
MFCD00192141
IUPAC Name:
ethyl 3,5-dichloro-4-hydroxybenzoate
InChI:
InChI=1S/C9H8Cl2O3/c1-2-14-9(13)5-3-6(10)8(12)7(11)4-5/h3-4,12H,2H2,1H3
InChI Key:
WMKNGSJJEMFQOT-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1cc(Cl)c(c(c1)Cl)O
EC Number:
241-331-2
NSC Number:
74473
Properties
Complexity:
198  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
233.985g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
235.06g/mol
Monoisotopic Mass:
233.985g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3  
Literature
Title Journal
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. Bioorganic & medicinal chemistry letters 20101101
Properties