AG00FGDK

74447-38-4 | 4-(2-Hydroxyethyl)phenyl methanesulfonate

AG00FGDK

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CAS Number	74447-38-4
Catalog Number	AG00FGDK(AGN-PC-0WD3LD)
Chemical Name	4-(2-Hydroxyethyl)phenyl methanesulfonate
IUPAC Name	[4-(2-hydroxyethyl)phenyl] methanesulfonate
InChI	InChI=1S/C9H12O4S/c1-14(11,12)13-9-4-2-8(3-5-9)6-7-10/h2-5,10H,6-7H2,1H3
InChI Key	WMXAVUZTTMTGAO-UHFFFAOYSA-N
MDL Number	MFCD19382353
Molecular Formula	C9H12O4S
Molecular Weight	216.2542
SMILES	CS(=O)(=O)Oc1ccc(CCO)cc1
Synonyms	4-(2-Hydroxyethyl)phenyl methanesulfonate, 74447-38-4, SCHEMBL5994202, DTXSID40629370, WMXAVUZTTMTGAO-UHFFFAOYSA-N, ACT10168, MFCD19382353, ZINC66054498, 2-(4-methanesulfonyloxyphenyl)ethanol, AKOS022172975, FCH1357413, 2-[4-(methylsulfonyloxy)phenyl]-1-ethanol, AJ-115664, AX8281038, 2-(4-methylsulphonyloxyphenyl)ethanol,

Complexity	247
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	216.046g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	216.251g/mol
Monoisotopic Mass	216.046g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	72A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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