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82081-37-6 | 4-(thiolan-2-yl)pyridine
CAS No: 82081-37-6 Catalog No: AG01AHYQ MDL No:MFCD18838759
Product Description
Catalog Number:
AG01AHYQ
Chemical Name:
4-(thiolan-2-yl)pyridine
CAS Number:
82081-37-6
Molecular Formula:
C9H11NS
Molecular Weight:
165.2553
MDL Number:
MFCD18838759
IUPAC Name:
4-(thiolan-2-yl)pyridine
InChI:
InChI=1S/C9H11NS/c1-2-9(11-7-1)8-3-5-10-6-4-8/h3-6,9H,1-2,7H2
InChI Key:
PTDLMLOSMYPGAV-UHFFFAOYSA-N
SMILES:
C1CSC(C1)c1ccncc1
Properties
Complexity:
121
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
165.061g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
165.254g/mol
Monoisotopic Mass:
165.061g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
38.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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