Home Other Building Blocks 3-fluoro-4-(methoxymethyl)benzoic acid

3-fluoro-4-(methoxymethyl)benzoic acid

CAS No.:
477199-79-4
Catalog Number:
AG01BRWX
Molecular Formula:
C9H9FO3
Molecular Weight:
184.1644
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Product Description
Catalog Number:
AG01BRWX
Chemical Name:
3-fluoro-4-(methoxymethyl)benzoic acid
CAS Number:
477199-79-4
Molecular Formula:
C9H9FO3
Molecular Weight:
184.1644
MDL Number:
MFCD17287384
IUPAC Name:
3-fluoro-4-(methoxymethyl)benzoic acid
InChI:
InChI=1S/C9H9FO3/c1-13-5-7-3-2-6(9(11)12)4-8(7)10/h2-4H,5H2,1H3,(H,11,12)
InChI Key:
RTMKJBUFKULHHT-UHFFFAOYSA-N
SMILES:
COCc1ccc(cc1F)C(=O)O
Properties
Complexity:
184  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
184.054g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
184.166g/mol
Monoisotopic Mass:
184.054g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  
Properties