AG003K4H

83846-85-9 | 4-(4-METHYLPHENYLTHIO)BENZOPHENONE

AG003K4H

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CAS Number	83846-85-9
Catalog Number	AG003K4H(AGN-PC-0JPTEA)
Chemical Name	4-(4-METHYLPHENYLTHIO)BENZOPHENONE
EC Number	281-064-9
IUPAC Name	[4-(4-methylphenyl)sulfanylphenyl]-phenylmethanone
InChI	InChI=1S/C20H16OS/c1-15-7-11-18(12-8-15)22-19-13-9-17(10-14-19)20(21)16-5-3-2-4-6-16/h2-14H,1H3
InChI Key	DBHQYYNDKZDVTN-UHFFFAOYSA-N
MDL Number	MFCD00055651
Molecular Formula	C20H16OS
Molecular Weight	304.4054
SMILES	O=C(C1=CC=CC=C1)C2=CC=C(SC3=CC=C(C)C=C3)C=C2
Synonyms	83846-85-9, 4-(4-Methylphenylthio)benzophenone, 4-(p-Tolylthio)benzophenone, Phenyl(4-(p-tolylthio)phenyl)methanone, 4-Methyl-4'-benzoyldiphenyl sulfide, 4-Benzoyl 4'-Methyldiphenyl Sulfide, {4-[(4-Methylphenyl)thio]phenyl}(phenyl)methanone, Methanone, (4-((4-methylphenyl)thio)phenyl)phenyl-, Methanone, [4-[(4-methylphenyl)thio]phenyl]phenyl-, W-104133, {4-[(4-methylphenyl)sulfanyl]phenyl}(phenyl)methanone, [4-[(4-methylphenyl)thio]phenyl](phenyl)methanone, speedcure bmds, syncure bms, C20H16OS, Quantacure BMS, Quantacure DMS, Kayacure BMS, EINECS 281-064-9, ACMC-20amvp, AC1L5B3J, SCHEMBL51730, 4-(p-tolylthio) benzophenone, 4-(p-Tolylthio)-benzophenone, CTK8C5914, DBHQYYNDKZDVTN-UHFFFAOYSA-N, Phenyl (p-tolylthio)phenyl ketone, 4-Benzoyl 4'methyldiphenyl sulfide, ZINC4289082, ZX-AT028281, 4-benzoyl-4'-methyldiphenyl sulfide, MFCD00055651, STK332367, 4-benzoyl-4'-methyl diphenyl sulfide, 4-Benzoyl 4\'-Methyldiphenyl Sulfide, 4-benzoyl-4'-methyl diphenyl sulphide, 4-benzoylphenyl 4-methylphenyl sulfide, AKOS005440312, CCG-245131, MCULE-4215630604, TRA0078512, VZ29391, ACM26960792, AC-16499, AJ-50274, AN-36006, Q173, AX8009071, phenyl-[4-(p-tolylsulfanyl)phenyl]methanone, TL8006842, TR-010124, FT-0617633, [4-[(4-methylphenyl)thio]phenyl]phenyl-methanon, [4-(4-methylphenyl)sulfanylphenyl]-phenylmethanone, [4-[(4-methylphenyl)thio]phenyl]-phenylmethanone, 846M859, A840666, C-18980, [4-(4-methylphenyl)sulfanylphenyl]-phenyl-methanone, I09-1503, BRD-K50367503-001-01-7, (4-[(4-Methylphenyl)sulfanyl]phenyl)(phenyl)methanone #, 26960-79-2, 4-Methyl-4-benzoyldiphenylsulfide, 4-Bromo-1,8-naphthalic anhydride, C20-H16-O-S, CID174341, ZINC04289082, B1267, 81-86-7,

Complexity	345
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	304.092g/mol
Formal Charge	0
Heavy Atom Count	22
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	304.407g/mol
Monoisotopic Mass	304.092g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	42.4A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	5.9

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H315-H319
Packing Group
Precautionary statements	P264-P280-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313
UN Code

Certificate of Analysis

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