Home Carboxys 5-[(2,4-difluorophenoxy)methyl]-1,2-oxazole-3-carboxylic acid

5-[(2,4-difluorophenoxy)methyl]-1,2-oxazole-3-carboxylic acid

CAS No.:
932917-90-3
Catalog Number:
AG01B2LM
Molecular Formula:
C11H7F2NO4
Molecular Weight:
255.1744
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Product Description
Catalog Number:
AG01B2LM
Chemical Name:
5-[(2,4-difluorophenoxy)methyl]-1,2-oxazole-3-carboxylic acid
CAS Number:
932917-90-3
Molecular Formula:
C11H7F2NO4
Molecular Weight:
255.1744
MDL Number:
MFCD10485498
IUPAC Name:
5-[(2,4-difluorophenoxy)methyl]-1,2-oxazole-3-carboxylic acid
InChI:
InChI=1S/C11H7F2NO4/c12-6-1-2-10(8(13)3-6)17-5-7-4-9(11(15)16)14-18-7/h1-4H,5H2,(H,15,16)
InChI Key:
MEAKHCHVZCABQN-UHFFFAOYSA-N
SMILES:
Fc1ccc(c(c1)F)OCc1onc(c1)C(=O)O
Properties
Complexity:
305  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
255.034g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
255.177g/mol
Monoisotopic Mass:
255.034g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
72.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  
Properties