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Home > Fluorides > 114260-11-6
114260-11-6 | Benzenecarbodithioic acid, 2-fluoro-, methyl ester
CAS No: 114260-11-6 Catalog No: AG000AXE MDL No:
Product Description
Catalog Number:
AG000AXE
Chemical Name:
Benzenecarbodithioic acid, 2-fluoro-, methyl ester
CAS Number:
114260-11-6
Molecular Formula:
C8H7FS2
Molecular Weight:
186.2696
IUPAC Name:
methyl 2-fluorobenzenecarbodithioate
InChI:
InChI=1S/C8H7FS2/c1-11-8(10)6-4-2-3-5-7(6)9/h2-5H,1H3
InChI Key:
BHPLCOIEFKQVGP-UHFFFAOYSA-N
SMILES:
CSC(=S)c1ccccc1F
Properties
Complexity:
147
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
185.997g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
186.262g/mol
Monoisotopic Mass:
185.997g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
57.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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