Home Other Building Blocks 2-(2,2-difluoroethoxy)-4-methoxybenzoic acid

2-(2,2-difluoroethoxy)-4-methoxybenzoic acid

CAS No.:
937602-72-7
Catalog Number:
AG01BCQ6
Molecular Formula:
C10H10F2O4
Molecular Weight:
232.1808
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Product Description
Catalog Number:
AG01BCQ6
Chemical Name:
2-(2,2-difluoroethoxy)-4-methoxybenzoic acid
CAS Number:
937602-72-7
Molecular Formula:
C10H10F2O4
Molecular Weight:
232.1808
MDL Number:
MFCD08696491
IUPAC Name:
2-(2,2-difluoroethoxy)-4-methoxybenzoic acid
InChI:
InChI=1S/C10H10F2O4/c1-15-6-2-3-7(10(13)14)8(4-6)16-5-9(11)12/h2-4,9H,5H2,1H3,(H,13,14)
InChI Key:
WVWRSFVTTCDZTR-UHFFFAOYSA-N
SMILES:
COc1ccc(c(c1)OCC(F)F)C(=O)O
Properties
Complexity:
235  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
232.055g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
232.183g/mol
Monoisotopic Mass:
232.055g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
55.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  
Properties