Benzenecarbothioamide, 3-methoxy-


Chemical Name: Benzenecarbothioamide, 3-methoxy-
CAS Number: 64559-06-4
Product Number: AG003JO6(AGN-PC-0KBOOE)
Synonyms:
MDL No:
Molecular Formula: C8H9NOS
Molecular Weight: 167.2282

Identification/Properties


Properties
Storage:
Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
167.226g/mol
XLogP3:
1.4
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
2
Exact Mass:
167.04g/mol
Monoisotopic Mass:
167.04g/mol
Topological Polar Surface Area:
67.3A^2
Heavy Atom Count:
11
Formal Charge:
0
Complexity:
149
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:
H317-H319
Precautionary Statements:
P280-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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