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16718-12-0 | Thiophene, 2-(phenylthio)-
CAS No: 16718-12-0 Catalog No: AG001X6Q MDL No:MFCD00052141
Product Description
Catalog Number:
AG001X6Q
Chemical Name:
Thiophene, 2-(phenylthio)-
CAS Number:
16718-12-0
Molecular Formula:
C10H8S2
Molecular Weight:
192.3005
MDL Number:
MFCD00052141
IUPAC Name:
2-phenylsulfanylthiophene
InChI:
InChI=1S/C10H8S2/c1-2-5-9(6-3-1)12-10-7-4-8-11-10/h1-8H
InChI Key:
JQTBWKNYWACCRU-UHFFFAOYSA-N
SMILES:
c1ccc(cc1)Sc1cccs1
Properties
Complexity:
130
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
192.007g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
192.294g/mol
Monoisotopic Mass:
192.007g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
53.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4
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