Home Nitros 1-fluoro-3-(methylsulfanyl)-2-nitrobenzene

1-fluoro-3-(methylsulfanyl)-2-nitrobenzene

CAS No.:
305811-06-7
Catalog Number:
AG01ACAV
Molecular Formula:
C7H6FNO2S
Molecular Weight:
187.1914
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Product Description
Catalog Number:
AG01ACAV
Chemical Name:
1-fluoro-3-(methylsulfanyl)-2-nitrobenzene
CAS Number:
305811-06-7
Molecular Formula:
C7H6FNO2S
Molecular Weight:
187.1914
MDL Number:
MFCD16839131
IUPAC Name:
1-fluoro-3-methylsulfanyl-2-nitrobenzene
InChI:
InChI=1S/C7H6FNO2S/c1-12-6-4-2-3-5(8)7(6)9(10)11/h2-4H,1H3
InChI Key:
SNNYYCCMWXRDTI-UHFFFAOYSA-N
SMILES:
CSc1cccc(c1[N+](=O)[O-])F
Properties
Complexity:
173  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
187.01g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
187.188g/mol
Monoisotopic Mass:
187.01g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
71.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  
Properties