AG002J9E

207738-08-7 | 3,3,5,5-TETRAMETHYLBENZIDINE DIHYDROCHLORIDE HYDRATE

AG002J9E

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CAS Number	207738-08-7
Catalog Number	AG002J9E(AGN-PC-0QWLSG)
Chemical Name	3,3,5,5-TETRAMETHYLBENZIDINE DIHYDROCHLORIDE HYDRATE
IUPAC Name	4-(4-amino-3,5-dimethylphenyl)-2,6-dimethylaniline;hydrate;hydrochloride
InChI	InChI=1S/C16H20N2.ClH.H2O/c1-9-5-13(6-10(2)15(9)17)14-7-11(3)16(18)12(4)8-14;;/h5-8H,17-18H2,1-4H3;1H;1H2
InChI Key	RNDZFHZLHIXBSY-UHFFFAOYSA-N
MDL Number	MFCD03065942
Molecular Formula	C16H24Cl2N2O
Molecular Weight	331.2806
SMILES	NC1=C(C)C=C(C2=CC(C)=C(N)C(C)=C2)C=C1C.[H]Cl.[H]Cl.[H]O[H]
Synonyms	207738-08-7, 3,3',5,5'-Tetramethyl-[1,1'-biphenyl]-4,4'-diamine hydrochloride hydrate(1:2:x), 3,3',5,5'-Tetramethylbenzidine dihydrochloride hydrate, 3,3',5,5'-tetramethylbiphenyl-4,4'-diamine hydrochloride hydrate, KS-00000U5O, AKOS030621432, AK668408, DS-19893, 4-(4-amino-3,5-dimethylphenyl)-2,6-dimethylaniline hydrate hydrochloride, 3,3',5,5'-Tetramethylbenzidine dihydrochloride hydrate, 98% - 1G 1g,

Complexity	226
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	3
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	294.15g/mol
Formal Charge	0
Heavy Atom Count	20
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	4
Isotope Atom Count	0
Molecular Weight	294.823g/mol
Monoisotopic Mass	294.15g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	53A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0

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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