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Disperse yellow 3

CAS No.:
2832-40-8
Catalog Number:
AG003PRK
Molecular Formula:
C15H15N3O2
Molecular Weight:
269.2985
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
In Stock USA
United States
$57
- +
5g
In Stock USA
United States
$87
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25g
In Stock USA
United States
$172
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100g
In Stock USA
United States
$483
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Product Description
Catalog Number:
AG003PRK
Chemical Name:
Disperse yellow 3
CAS Number:
2832-40-8
Molecular Formula:
C15H15N3O2
Molecular Weight:
269.2985
MDL Number:
MFCD00002377
IUPAC Name:
N-[4-[(2-hydroxy-5-methylphenyl)diazenyl]phenyl]acetamide
InChI:
InChI=1S/C15H15N3O2/c1-10-3-8-15(20)14(9-10)18-17-13-6-4-12(5-7-13)16-11(2)19/h3-9,20H,1-2H3,(H,16,19)
InChI Key:
PXOZAFXVEWKXED-UHFFFAOYSA-N
SMILES:
CC(=O)Nc1ccc(cc1)N=Nc1cc(C)ccc1O
EC Number:
220-600-8
UNII:
0890872E2E
Properties
Complexity:
351  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
269.116g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
269.304g/mol
Monoisotopic Mass:
269.116g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
74A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  
Literature
Title Journal
Contact sensitization in very young children. Journal of the American Academy of Dermatology 20111001
Reactivity of in vitro activated human T lymphocytes to p-phenylenediamine and related substances. Contact dermatitis 20081001
Diaminodiphenylmethane (DDM): frequency of sensitization, clinical relevance and concomitant positive reactions. Contact dermatitis 20010501
[Allergy to dyes in stockings]. Deutsche medizinische Wochenschrift (1946) 19840928
Properties