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Home > Pyridines > 756804-90-7
756804-90-7 | 4-Pyridinethiol,1-butyl-1,4-dihydro-(9CI)
CAS No: 756804-90-7 Catalog No: AG00GHPF MDL No:
Product Description
Catalog Number:
AG00GHPF
Chemical Name:
4-Pyridinethiol,1-butyl-1,4-dihydro-(9CI)
CAS Number:
756804-90-7
IUPAC Name:
1-butyl-4H-pyridine-4-thiol
InChI:
InChI=1S/C9H15NS/c1-2-3-6-10-7-4-9(11)5-8-10/h4-5,7-9,11H,2-3,6H2,1H3
InChI Key:
PHZLIQRCRIAFQM-UHFFFAOYSA-N
Properties
Complexity:
149
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
169.093g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
169.286g/mol
Monoisotopic Mass:
169.093g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
4.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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