Home Other Building Blocks 5-fluoro-2-(pyridin-4-ylmethoxy)benzoic acid

5-fluoro-2-(pyridin-4-ylmethoxy)benzoic acid

CAS No.:
1351763-25-1
Catalog Number:
AG01BTMV
Molecular Formula:
C13H10FNO3
Molecular Weight:
247.2218
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Product Description
Catalog Number:
AG01BTMV
Chemical Name:
5-fluoro-2-(pyridin-4-ylmethoxy)benzoic acid
CAS Number:
1351763-25-1
Molecular Formula:
C13H10FNO3
Molecular Weight:
247.2218
MDL Number:
MFCD25670427
IUPAC Name:
5-fluoro-2-(pyridin-4-ylmethoxy)benzoic acid
InChI:
InChI=1S/C13H10FNO3/c14-10-1-2-12(11(7-10)13(16)17)18-8-9-3-5-15-6-4-9/h1-7H,8H2,(H,16,17)
InChI Key:
ZBCLKJYGVDTYIB-UHFFFAOYSA-N
SMILES:
Fc1ccc(c(c1)C(=O)O)OCc1ccncc1
Properties
Complexity:
281  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
247.064g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
247.225g/mol
Monoisotopic Mass:
247.064g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
59.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  
Properties