Benzaldehyde, 4-(methylthio)-


Chemical Name: Benzaldehyde, 4-(methylthio)-
CAS Number: 3446-89-7
Product Number: AG003LS6(AGN-PC-0JLQEF)
Synonyms:
MDL No:
Molecular Formula: C8H8OS
Molecular Weight: 152.2135

Identification/Properties


Properties
MP:
6 °C
BP:
86-90 °C1 mm Hg(lit.)
Storage:
Light sensitive;Inert atmosphere;Room Temperature;
Form:
Liquid
Stability:
Stench
Refractive Index:
n20/D 1.646(lit.)
Computed Properties
Molecular Weight:
152.211g/mol
XLogP3:
2
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
2
Exact Mass:
152.03g/mol
Monoisotopic Mass:
152.03g/mol
Topological Polar Surface Area:
42.4A^2
Heavy Atom Count:
10
Formal Charge:
0
Complexity:
106
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#:
N/A
Hazard Statements:
H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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