AG003PZK

39794-75-7 | Ethyl (p-tosyloxy)acetate

AG003PZK

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CAS Number	39794-75-7
Catalog Number	AG003PZK(AGN-PC-00GUOD)
Chemical Name	Ethyl (p-tosyloxy)acetate
IUPAC Name	ethyl 2-(4-methylphenyl)sulfonyloxyacetate
InChI	InChI=1S/C11H14O5S/c1-3-15-11(12)8-16-17(13,14)10-6-4-9(2)5-7-10/h4-7H,3,8H2,1-2H3
InChI Key	CVNRARCXNKDWKI-UHFFFAOYSA-N
MDL Number	MFCD18252874
Molecular Formula	C11H14O5S
Molecular Weight	258.2909
SMILES	O=C(OCC)COS(=O)(C1=CC=C(C)C=C1)=O
Synonyms	39794-75-7, Ethyl 2-(p-Toluenesulfonyloxy)acetate, Ethyl 2-(tosyloxy)acetate, (Toluene-4-sulfonyloxy)-acetic acid ethyl ester, ACMC-209j7s, Tosyloxyacetic acid ethyl ester, SCHEMBL1995195, CTK8B1613, DTXSID30473804, ETHYL (P-TOSYLOXY)ACETATE, CVNRARCXNKDWKI-UHFFFAOYSA-N, ANW-29174, MFCD18252874, ZINC36460620, FCH2797172, ACM39794757, TC-117919, E0851, ethyl {[(4-methylphenyl)sulfonyl]oxy}acetate, 2-(p-Toluenesulfonyloxy)acetic Acid Ethyl Ester, I14-101957, Ethyl 2-(4-methylphenyl)sulfonyloxyacetate, CID11821264,

Complexity	335
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	258.056g/mol
Formal Charge	0
Heavy Atom Count	17
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	258.288g/mol
Monoisotopic Mass	258.056g/mol
Rotatable Bond Count	6
Topological Polar Surface Area	78A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.9

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

Lot Number