AG006O99

99314-44-0 | (3-Methyloxetan-3-yl)methyl p-tosylate

AG006O99

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CAS Number	99314-44-0
Catalog Number	AG006O99(AGN-PC-0JCLQM)
Chemical Name	(3-Methyloxetan-3-yl)methyl p-tosylate
IUPAC Name	(3-methyloxetan-3-yl)methyl 4-methylbenzenesulfonate
InChI	InChI=1S/C12H16O4S/c1-10-3-5-11(6-4-10)17(13,14)16-9-12(2)7-15-8-12/h3-6H,7-9H2,1-2H3
InChI Key	PZOQQSOZRVZCMC-UHFFFAOYSA-N
MDL Number	MFCD08275394
Molecular Formula	C12H16O4S
Molecular Weight	256.3180
SMILES	CC1=CC=C(C=C1)S(=O)(=O)OCC1(C)COC1
Synonyms	99314-44-0, (3-methyloxetan-3-yl)methyl 4-methylbenzenesulfonate, (3-methyl-3-oxetanyl)methyl 4-methylbenzenesulfonate, (3-METHYLOXETAN-3-YL)METHYL P-TOSYLATE, MFCD08275394, AK-98825, 3-METHYL-3-(TOLUENESULFONYLOXYMETHYL)OXETANE, J-501224, (3-methyloxetan-3-yl)methyl 4-methylbenzene-1-sulfonate, UPCMLD00WCRH3-139, 3-(Tosyloxymethyl)-3-methyloxetane, AC1NUUDY, SCHEMBL277105, DTXSID40420127, PZOQQSOZRVZCMC-UHFFFAOYSA-N, KS-00000NO0, 6961AC, ANW-71314, SBB101748, ZINC22995871, AKOS005072565, AB44792, FCH2817123, GC-0776, LS40977, RP14550, (3-Methyl-3-oxetanyl)methyl p-tosylate, methyloxetanylmethylmethylbenzenesulfonate, AJ-81577, AM808080, OR350275, SC-70548, SY110043, AX8088006, ST2402344, TR-030424, 4CH-000478, FT-0681078, MFCD08275394 (97%), (3-methyloxetan-3-yl)methyl 4-toluenesulfonate, C-4440, 3-methyl-3-(4-toluenesulphonyloxymethyl)-oxetane, (3-methyl-3-oxetanyl)methyl-4-methylbenzenesulfonate, I01-13706, toluene-4-sulfonic acid 3-methyl-oxetan-3-ylmethyl ester, Toluene-4-sulfonic acid 3-methyloxetan-3-ylmethyl ester, (3-METHYLOXETAN-3-YL)METHYL4-METHYLBENZENESULFONATE, 3-Oxetanemethanol, 3-methyl-, 3-(4-methylbenzenesulfonate), C12H16O4S, ACN-046614, CID5461213, (3-Methyloxetan-3-yl)methyl 4-methylbenzenesulfote,

Complexity	345
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	256.077g/mol
Formal Charge	0
Heavy Atom Count	17
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	256.316g/mol
Monoisotopic Mass	256.077g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	61A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.7

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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