3,3,5,5-Tetramethylbenzidine

CAT: 0063-29622681-5gSize: 5 gDry Ice: NoHazardous: No

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CAT#:0063-29622681-5gSize:5 g

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CAS Number

54827-17-7

Molecular Formula

C16H20N2

Molecular Weight

240.34

Formulation

C16H20N2

Chemical Information

3,3',5,5'-Tetramethylbenzidine

3,3',5,5'-tetramethylbenzidine appears as pale yellow crystals or off-white powder. (NTP, 1992)

CAS Number	54827-17-7
PubChem CID	41206
IUPAC Name	4-(4-amino-3,5-dimethylphenyl)-2,6-dimethylaniline
Molecular Formula	C16H20N2
Molecular Weight	240.34
XLogP	3.6
Topological Polar Surface Area	52
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	1
Heavy Atom Count	18
Formal Charge	0
Complexity	226

SMILES

CC1=CC(=CC(=C1N)C)C2=CC(=C(C(=C2)C)N)C

InChI

InChI=1S/C16H20N2/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

InChIKey

UAIUNKRWKOVEES-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 54827-17-7

CID: 41206

Formula: C16H20N2

MW: 240.34

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	240.34
XLogP3	3.6
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	1
Exact Mass	240.162648646
Monoisotopic Mass	240.162648646
Topological Polar Surface Area	52 Å²
Heavy Atom Count	18
Formal Charge	0
Complexity	226
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
17573857-100g	3,5-Dimethylphenol (3,5-Xylenol)
17573857	3,5-Dimethylphenol (3,5-Xylenol)
15131983	2,3,5-Collidine (2,3,5-Trimethylpyridine)
15131983-25g	2,3,5-Collidine (2,3,5-Trimethylpyridine)
10632563-01	3,5-Dimethoxyphenol
10318007-01	3,5-Dibromopyridine
10318007-25g	3,5-Dibromopyridine
10632563-5g	3,5-Dimethoxyphenol
19405006	3,5-Difluorophenol
10632563-25g	3,5-Dimethoxyphenol

Catalog	Name
289725-01	3,3',5,5'-Tetramethylbenzidine
GE8825-5g	3,3'',5,5''-Tetramethylbenzidine
02660 00005	3,3',5,5'-Tetramethylbenzidine 99%
OR1010745-01	3,3',5,5'-Tetramethylbenzidine dihydrochloride
232212-01	3,3',5,5'-Tetramethylbenzidine 99.5+%
BIB6275-01	3,3',5,5'-Tetramethylbenzidine, dihydrochloride hydrate
BIB6274-01	3,3',5,5'-Tetramethylbenzidine, free base
GE6063-5g	3,3'',5,5''-Tetramethylbenzidine dihydrochloride hydrate
sc-206697	3,3',5,5'-Tetramethylbenzidine dihydrochloride anhydrous
sc-205527	3,3',5,5'-Tetramethylbenzidine dihydrochloride dihydrate