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Home > Fluorides > 1379331-73-3
1379331-73-3 | 2-(4-Fluoro-1-naphthyl)ethanethiol
CAS No: 1379331-73-3 Catalog No: AG01FE6H MDL No:
Product Description
Catalog Number:
AG01FE6H
Chemical Name:
2-(4-Fluoro-1-naphthyl)ethanethiol
CAS Number:
1379331-73-3
Molecular Formula:
C12H11FS
Molecular Weight:
206.2791
IUPAC Name:
2-(4-fluoronaphthalen-1-yl)ethanethiol
InChI:
InChI=1S/C12H11FS/c13-12-6-5-9(7-8-14)10-3-1-2-4-11(10)12/h1-6,14H,7-8H2
InChI Key:
SOAWUOVZJWMOQC-UHFFFAOYSA-N
SMILES:
SCCc1ccc(c2c1cccc2)F
Properties
Complexity:
183
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
206.057g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
206.278g/mol
Monoisotopic Mass:
206.057g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8
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