AG00343U

6873-55-8 | 4-Methylbenzenesulfinamide

AG00343U

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CAS Number	6873-55-8
Catalog Number	AG00343U(AGN-PC-0JTCSC)
Chemical Name	4-Methylbenzenesulfinamide
IUPAC Name	4-methylbenzenesulfinamide
InChI	InChI=1S/C7H9NOS/c1-6-2-4-7(5-3-6)10(8)9/h2-5H,8H2,1H3
InChI Key	YNJDSRPIGAUCEE-UHFFFAOYSA-N
MDL Number	MFCD02093698
Molecular Formula	C7H9NOS
Molecular Weight	155.2175
SMILES	O=S(C1=CC=C(C)C=C1)N
Synonyms	4-Methylbenzenesulfinamide, 6873-55-8, 4-METHYL-BENZENESULFINAMIDE, Benzenesulfinamide, 4-methyl-, YNJDSRPIGAUCEE-UHFFFAOYSA-N, p-Toluenesulfinylamide, p-tolylsulfinamide, p-toluene sulfinamide, AC1LBQWE, ACMC-20a52q, PARA-TOLENESULFINAMIDE, 4-Methylbenzenesulfinamide #, 4-methylbenzene-1-sulfinamide, SCHEMBL358582, (R)-4-Methylbezenesulfinamide, (R)-(?)-p-Toluenesulfinamide, CTK5C8381, DTXSID60343102, ACT09400, KS-000001IJ, FCH831395, MFCD02093698, AKOS002665446, TRA-0195705, AK311275, AN-30415, SY114833, AB0005901, MFCD06858375 (97%), A813231, A817450, p-Tolylsulfinylamine, (S)-(+)-p-Toluenesulfinamide, 4-Methylbenzenesulphinamide, (R)-4-TOLUENESULFINAMIDE, (S)-4-Methylbezenesulfinamide, (S)-4-methylbenzenesulfinamide, CID587460, 188447-91-8, 247089-85-6, 15795-42-3,

Complexity	130
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	155.04g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	155.215g/mol
Monoisotopic Mass	155.04g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	62.3A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	1.2

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