Home Other Building Blocks 2-fluoro-3-isopropoxybenzoic acid

2-fluoro-3-isopropoxybenzoic acid

CAS No.:
1346608-65-8
Catalog Number:
AG01BJA0
Molecular Formula:
C10H11FO3
Molecular Weight:
198.1909
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Product Description
Catalog Number:
AG01BJA0
Chemical Name:
2-fluoro-3-isopropoxybenzoic acid
CAS Number:
1346608-65-8
Molecular Formula:
C10H11FO3
Molecular Weight:
198.1909
MDL Number:
MFCD28356761
IUPAC Name:
2-fluoro-3-propan-2-yloxybenzoic acid
InChI:
InChI=1S/C10H11FO3/c1-6(2)14-8-5-3-4-7(9(8)11)10(12)13/h3-6H,1-2H3,(H,12,13)
InChI Key:
ADISUGFAMDFUHD-UHFFFAOYSA-N
SMILES:
CC(Oc1cccc(c1F)C(=O)O)C
Properties
Complexity:
206  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
198.069g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
198.193g/mol
Monoisotopic Mass:
198.069g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  
Properties