1-Propanol, 3-(methylthio)-


Chemical Name: 1-Propanol, 3-(methylthio)-
CAS Number: 505-10-2
Product Number: AG00I92G(AGN-PC-0JK9K5)
Synonyms:
MDL No:
Molecular Formula: C4H10OS
Molecular Weight: 106.1866

Identification/Properties


Properties
MP:
-100°C (estimate)
BP:
89-90°C at 12.75 mmHg
Storage:
Keep in dry area;2-8℃;
Form:
Liquid
Refractive Index:
n20/D 1.49(lit.)
Computed Properties
Molecular Weight:
106.183g/mol
XLogP3:
0.5
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
3
Exact Mass:
106.045g/mol
Monoisotopic Mass:
106.045g/mol
Topological Polar Surface Area:
45.5A^2
Heavy Atom Count:
6
Formal Charge:
0
Complexity:
23.5
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:
1
Compound Is Canonicalized:
Yes

Safety Information


NMR Spectrum


Other Analytical Data


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