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2,4-Diaminophenol

CAT: 1299-RG-A263370-01Size: 10 mgDry Ice: NoHazardous: No
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CAT#:1299-RG-A263370-01Size:10 mg
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CAS Number
95-86-3
Synonyms
2,4-diaminophenol
Molecular Formula
C6H8N2O
Molecular Weight
124.14
Product Name Synonym
2,4-diaminophenol

Chemical Information

2,4-Diaminophenol

On the basis of the data included in this report, the CIR Expert Panel concludes that 2,4-Diaminophenol and 2,4-Diaminophenol Dihydrochloride are safe for use in hair dyes at concentrations up to 0.2% (as the free base). 2009 RE-REVIEW - The Expert Panel noted that 2,4-Diaminophenol Dihydrochloride is now termed 2,4-Diaminophenol Hydrochloride.

CAS Number95-86-3
PubChem CID7266
IUPAC Name2,4-diaminophenol
Molecular FormulaC6H8N2O
Molecular Weight124.14
XLogP0.5
Topological Polar Surface Area72.3
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count3
Rotatable Bond Count0
Heavy Atom Count9
Formal Charge0
Complexity97
SMILES
C1=CC(=C(C=C1N)N)O
InChI
InChI=1S/C6H8N2O/c7-4-1-2-6(9)5(8)3-4/h1-3,9H,7-8H2
InChIKey
XIWMTQIUUWJNRP-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2,4-Diaminophenol
CAS: 95-86-3
CID: 7266
Formula: C6H8N2O
MW: 124.14
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight124.14
XLogP30.5
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count3
Rotatable Bond Count0
Exact Mass124.063662883
Monoisotopic Mass124.063662883
Topological Polar Surface Area72.3 Ų
Heavy Atom Count9
Formal Charge0
Complexity97.1
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
273516-012,4-Diaminophenol 2HCl
TRC-D416555-250MG2,4-Diaminophenol Dihydrochloride
OR10776442,4-Diaminophenol Sulfate
AR-B06498-012,4-Diaminophenol DiHCl
AR-B01262-013,4-Diaminophenol
sc-2562762,3-Diaminophenol
OR1103024-013,4-Diaminophenol dihydrochloride
TRC-D416648-50MG3,4-Diaminophenol (>80%)
426921-013,4-Diaminophenol Hydrochloride
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