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Home Other Building Blocks 2-(2-Chlorophenoxy)-2-methylpropanoic acid

2-(2-Chlorophenoxy)-2-methylpropanoic acid

CAS No.:
17413-79-5
Catalog Number:
AG001ZHF
Molecular Formula:
C10H11ClO3
Molecular Weight:
214.6455
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
500mg
95%
In Stock USA
United States
$182
- +
1g
95%
In Stock USA
United States
$225
- +
5g
95%
In Stock USA
United States
$788
- +
10g
95%
In Stock USA
United States
$1350
- +
Product Description
Catalog Number:
AG001ZHF
Chemical Name:
2-(2-Chlorophenoxy)-2-methylpropanoic acid
CAS Number:
17413-79-5
Molecular Formula:
C10H11ClO3
Molecular Weight:
214.6455
MDL Number:
MFCD00056708
IUPAC Name:
2-(2-chlorophenoxy)-2-methylpropanoic acid
InChI:
InChI=1S/C10H11ClO3/c1-10(2,9(12)13)14-8-6-4-3-5-7(8)11/h3-6H,1-2H3,(H,12,13)
InChI Key:
ZEQSWIRBIUYYFA-UHFFFAOYSA-N
SMILES:
OC(=O)C(Oc1ccccc1Cl)(C)C
Properties
Complexity:
215  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
214.04g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
214.645g/mol
Monoisotopic Mass:
214.04g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7  
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