AG0006HR

102062-36-2 | 1-Propanesulfonic acid, 3-[(4'-amino-3,3',5,5'-tetramethyl[1,1'-biphenyl]-4-yl)amino]-

AG0006HR

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CAS Number	102062-36-2
Catalog Number	AG0006HR(AGN-PC-0OR675)
Chemical Name	1-Propanesulfonic acid, 3-[(4'-amino-3,3',5,5'-tetramethyl[1,1'-biphenyl]-4-yl)amino]-
IUPAC Name	3-[4-(4-amino-3,5-dimethylphenyl)-2,6-dimethylanilino]propane-1-sulfonic acid
InChI	InChI=1S/C19H26N2O3S/c1-12-8-16(9-13(2)18(12)20)17-10-14(3)19(15(4)11-17)21-6-5-7-25(22,23)24/h8-11,21H,5-7,20H2,1-4H3,(H,22,23,24)
InChI Key	GZNAFYJQMXPVSY-UHFFFAOYSA-N
MDL Number	MFCD00077876
Molecular Formula	C19H26N2O3S
Molecular Weight	362.4863
SMILES	NC1=C(C=C(C=C1C)C1=CC(=C(C(=C1)C)NCCCS(=O)(=O)O)C)C
Synonyms	TMB-PS, 102062-36-2, N-(3-Sulfopropyl)-3,3',5,5'-tetramethylbenzidine sodium salt, N-(3-Sulfopropyl)-3,3 ,5,5 -tetramethylbenzidine sodium salt, TMB-PS Robiot, PubChem19814, SCHEMBL574723, ZINC4521845, AKOS015914143, CS-3053, AJ-51461, HY-15931, 062T362, n-(3-sulfopropyl)-3,3',5,5'-tetramethylbenzidine, N-(3-sulfopropyl)3,3',5,5'-tetramethyl-benzidine, I14-43436, N-(3-sulfopropyl)-3,3',5,5-tetramethylbenzidine,sodium salt, N-(3-Sulfopropyl)-3,3',5,5'-tetramethylbenzidine sodium salt (TMB-PS), 1-Propanesulfonic acid, 3-[(4'-amino-3,3',5,5'-tetramethyl[1,1'-biphenyl]-4-yl)amino]-, 3-((4'-Amino-3,3',5,5'-tetramethyl-[1,1'-biphenyl]-4-yl)amino)propane-1-sulfonic acid, 3-((4-Amino-3,3,5,5-tetramethyl-[1,1-biphenyl]-4-yl)amino)propane-1-sulfonic acid, 3-[4-(4-amino-3,5-dimethylphenyl)-2,6-dimethylanilino]propane-1-sulfonic acid, 3-{[4-(4-AMINO-3,5-DIMETHYLPHENYL)-2,6-DIMETHYLPHENYL]AMINO}PROPANE-1-SULFONIC ACID, N-(3-Sulfopropyl)-3,3'5,5'-tetramethylbenzidine sodium salt, 3,3',5,5'-Tetramethylbenzidine propanesulfonic acid,sodium salt, 3-((1,1-Dimethyl-2-hydroxyethyl)amino)-2-hydroxypropanesulfonic acid sodium salt,

Complexity	495
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	362.166g/mol
Formal Charge	0
Heavy Atom Count	25
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	3
Isotope Atom Count	0
Molecular Weight	362.488g/mol
Monoisotopic Mass	362.166g/mol
Rotatable Bond Count	6
Topological Polar Surface Area	101A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.6

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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