Benzenamine, 4-(methylthio)-


Chemical Name: Benzenamine, 4-(methylthio)-
CAS Number: 104-96-1
Product Number: AG003K94(AGN-PC-0JL6Y2)
Synonyms:
MDL No:
Molecular Formula: C7H9NS
Molecular Weight: 139.2181

Identification/Properties


Properties
BP:
273.3°C at 760 mmHg
Storage:
Inert atmosphere;Room Temperature;
Form:
Liquid
Computed Properties
Molecular Weight:
139.216g/mol
XLogP3:
1.8
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
1
Exact Mass:
139.046g/mol
Monoisotopic Mass:
139.046g/mol
Topological Polar Surface Area:
51.3A^2
Heavy Atom Count:
9
Formal Charge:
0
Complexity:
77
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:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Danger
UN#:
2810
Hazard Statements:
H301-H311-H315-H319-H331-H335
Precautionary Statements:
P261-P264-P270-P271-P280-P301+P310-P302+P352-P304+P340-P305+P351+P338-P311-P330-P361-P363-P403+P233-P405-P501
Class:
6.1
Packing Group:

NMR Spectrum


Other Analytical Data


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