4-methylsulfanylpiperidine;hydrochloride


Chemical Name: 4-methylsulfanylpiperidine;hydrochloride
CAS Number: 208245-70-9
Product Number: AG002JLN(AGN-PC-08XZTZ)
Synonyms:
MDL No:
Molecular Formula: C6H14ClNS
Molecular Weight: 167.7001

Identification/Properties


Computed Properties
Molecular Weight:
167.695g/mol
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
1
Exact Mass:
167.054g/mol
Monoisotopic Mass:
167.054g/mol
Topological Polar Surface Area:
37.3A^2
Heavy Atom Count:
9
Formal Charge:
0
Complexity:
59.5
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
2
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
-
Hazard Statements:
H302+H312+H332-H315-H319-H335
Precautionary Statements:
P261-P280-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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