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28856-77-1 | 3-(phenylsulfanyl)pyridine
CAS No: 28856-77-1 Catalog No: AG01BAGT MDL No:MFCD00234708
Product Description
Catalog Number:
AG01BAGT
Chemical Name:
3-(phenylsulfanyl)pyridine
CAS Number:
28856-77-1
Molecular Formula:
C11H9NS
Molecular Weight:
187.2609
MDL Number:
MFCD00234708
IUPAC Name:
3-phenylsulfanylpyridine
InChI:
InChI=1S/C11H9NS/c1-2-5-10(6-3-1)13-11-7-4-8-12-9-11/h1-9H
InChI Key:
ONBQLBVFTYYJJR-UHFFFAOYSA-N
SMILES:
c1ccc(cc1)Sc1cccnc1
Properties
Complexity:
143
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
187.046g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
187.26g/mol
Monoisotopic Mass:
187.046g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
38.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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