Home Other Building Blocks Benzoic acid, 3-(fluoromethyl)-

Benzoic acid, 3-(fluoromethyl)-

CAS No.:
89540-19-2
Catalog Number:
AG008762
Molecular Formula:
C8H7FO2
Molecular Weight:
154.1384
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Product Description
Catalog Number:
AG008762
Chemical Name:
Benzoic acid, 3-(fluoromethyl)-
CAS Number:
89540-19-2
Molecular Formula:
C8H7FO2
Molecular Weight:
154.1384
MDL Number:
MFCD20658223
IUPAC Name:
3-(fluoromethyl)benzoic acid
InChI:
InChI=1S/C8H7FO2/c9-5-6-2-1-3-7(4-6)8(10)11/h1-4H,5H2,(H,10,11)
InChI Key:
MZBVPNDZYNYTSW-UHFFFAOYSA-N
SMILES:
FCc1cccc(c1)C(=O)O
Properties
Complexity:
147  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
154.043g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
154.14g/mol
Monoisotopic Mass:
154.043g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  
Properties