Home Other Building Blocks (3-fluorophenyl)methanesulfinic acid

(3-fluorophenyl)methanesulfinic acid

CAS No.:
1892392-25-4
Catalog Number:
AG01EIJW
Molecular Formula:
C7H7FO2S
Molecular Weight:
174.1927
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Product Description
Catalog Number:
AG01EIJW
Chemical Name:
(3-fluorophenyl)methanesulfinic acid
CAS Number:
1892392-25-4
Molecular Formula:
C7H7FO2S
Molecular Weight:
174.1927
MDL Number:
MFCD31559715
IUPAC Name:
(3-fluorophenyl)methanesulfinic acid
InChI:
InChI=1S/C7H7FO2S/c8-7-3-1-2-6(4-7)5-11(9)10/h1-4H,5H2,(H,9,10)
InChI Key:
BDHIEIJBAIYGBD-UHFFFAOYSA-N
SMILES:
OS(=O)Cc1cccc(c1)F
Properties
Complexity:
151  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
174.015g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
174.189g/mol
Monoisotopic Mass:
174.015g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
56.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  
Properties