Benzenecarbothioamide, 3-methyl-


Chemical Name: Benzenecarbothioamide, 3-methyl-
CAS Number: 2362-63-2
Product Number: AG002NY1(AGN-PC-0JVOJX)
Synonyms:
MDL No:
Molecular Formula: C8H9NS
Molecular Weight: 151.2288

Identification/Properties


Properties
MP:
87-89°C
BP:
272.1±33.0℃ (760 Torr)
Storage:
Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
151.227g/mol
XLogP3:
1.8
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
1
Rotatable Bond Count:
1
Exact Mass:
151.046g/mol
Monoisotopic Mass:
151.046g/mol
Topological Polar Surface Area:
58.1A^2
Heavy Atom Count:
10
Formal Charge:
0
Complexity:
133
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:
Warning
UN#:
-
Hazard Statements:
H302-H315-H319-H335
Precautionary Statements:
P261-P264-P270-P271-P280-P301+P312-P302+P352-P304+P340-P305+P351+P338-P330-P332+P313-P337+P313-P362-P403+P233-P405-P501
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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