AG00IXLV

22731-83-5 | (DIPHENYLIMINO-LAMBDA6-SULFANYL)ONE

AG00IXLV

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CAS Number	22731-83-5
Catalog Number	AG00IXLV(AGN-PC-0JR2X9)
Chemical Name	(DIPHENYLIMINO-LAMBDA6-SULFANYL)ONE
IUPAC Name	imino-oxo-diphenyl-λ6-sulfane
InChI	InChI=1S/C12H11NOS/c13-15(14,11-7-3-1-4-8-11)12-9-5-2-6-10-12/h1-10,13H
InChI Key	KNPJTNDEHOFWKA-UHFFFAOYSA-N
MDL Number	MFCD00507872
Molecular Formula	C12H11NOS
Molecular Weight	217.2868
NSC Number	172172
SMILES	N=S(C1=CC=CC=C1)(C2=CC=CC=C2)=O
Synonyms	(Phenylsulfonimidoyl)benzene, 22731-83-5, Sulfonimidoyldibenzene, (diphenylimino-lambda6-sulfanyl)one, NSC172172, Sulfoximine,S,S-diphenyl-, diphenyl sulfoximine, imino-oxo-diphenyl-, NSC 172172, S,S-Diphenylsulfoximine, AC1L8FAV, SCHEMBL2285511, CHEMBL1983563, CTK4F0048, KS-00002BGK, DTXSID60177267, imino-oxo-diphenyl-$l^{6}-sulfane, ZINC1692952, AKOS003238629, AKOS004112195, NSC-172172, SS-4968, AG-664/01339030, imino-oxo-diphenyl-lambda6-sulfane, CID425251, S,S-Diphenylsulfoximine, 95% - 1G 1g,

Complexity	271
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	217.056g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	217.286g/mol
Monoisotopic Mass	217.056g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	49.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.7

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	\N
Hazard statements	H302-H315-H319-H335
Packing Group	\N
Precautionary statements	P261-P280-P301+P312-P302+P352-P305+P351+P338
UN Code	\N

Certificate of Analysis

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