Home Halogens 2-(2-bromo-4-methylphenoxy)propanoic acid

2-(2-bromo-4-methylphenoxy)propanoic acid

CAS No.:
926252-65-5
Catalog Number:
AG019V6N
Molecular Formula:
C10H11BrO3
Molecular Weight:
259.0965
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Product Description
Catalog Number:
AG019V6N
Chemical Name:
2-(2-bromo-4-methylphenoxy)propanoic acid
CAS Number:
926252-65-5
Molecular Formula:
C10H11BrO3
Molecular Weight:
259.0965
MDL Number:
MFCD08442210
IUPAC Name:
2-(2-bromo-4-methylphenoxy)propanoic acid
InChI:
InChI=1S/C10H11BrO3/c1-6-3-4-9(8(11)5-6)14-7(2)10(12)13/h3-5,7H,1-2H3,(H,12,13)
InChI Key:
GHHXWCJVBYFPLG-UHFFFAOYSA-N
SMILES:
OC(=O)C(Oc1ccc(cc1Br)C)C
Properties
Complexity:
208  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
257.989g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
259.099g/mol
Monoisotopic Mass:
257.989g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  
Properties