Phenol, 2-(methylsulfonyl)-


Chemical Name: Phenol, 2-(methylsulfonyl)-
CAS Number: 27489-33-4
Product Number: AG00BEBZ(AGN-PC-0JTJZF)
Synonyms:
MDL No:
Molecular Formula: C7H8O3S
Molecular Weight: 172.2016

Identification/Properties


Computed Properties
Molecular Weight:
172.198g/mol
XLogP3:
1.4
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
1
Exact Mass:
172.019g/mol
Monoisotopic Mass:
172.019g/mol
Topological Polar Surface Area:
62.8A^2
Heavy Atom Count:
11
Formal Charge:
0
Complexity:
214
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:
H302-H319
Precautionary Statements:
P264-P270-P280-P301+P312+P330-P305+P351+P338-P337+P313-P501
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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