1H-Pyrrole, 2,5-dihydro-1-[(4-methylphenyl)sulfonyl]-


Chemical Name: 1H-Pyrrole, 2,5-dihydro-1-[(4-methylphenyl)sulfonyl]-
CAS Number: 16851-72-2
Product Number: AG003ENW(AGN-PC-0NGIOJ)
Synonyms:
MDL No:
Molecular Formula: C11H13NO2S
Molecular Weight: 223.2914

Identification/Properties


Properties
MP:
127 °C
BP:
354.167°C at 760 mmHg
Storage:
Inert atmosphere;Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
223.29g/mol
XLogP3:
1.7
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
2
Exact Mass:
223.067g/mol
Monoisotopic Mass:
223.067g/mol
Topological Polar Surface Area:
45.8A^2
Heavy Atom Count:
15
Formal Charge:
0
Complexity:
326
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:
H315-H319
Precautionary Statements:
P264-P280-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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