Acetonitrile, (methylsulfonyl)-


Chemical Name: Acetonitrile, (methylsulfonyl)-
CAS Number: 2274-42-2
Product Number: AG003F35(AGN-PC-0JLP9A)
Synonyms:
MDL No:
Molecular Formula: C3H5NO2S
Molecular Weight: 119.1423

Identification/Properties


Properties
MP:
81-84 °C(lit.)
Storage:
Keep in dry area;Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
119.138g/mol
XLogP3:
-1.4
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
1
Exact Mass:
119.004g/mol
Monoisotopic Mass:
119.004g/mol
Topological Polar Surface Area:
66.3A^2
Heavy Atom Count:
7
Formal Charge:
0
Complexity:
177
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:
H302+H312+H332
Precautionary Statements:
P280
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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