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Permanent Orange

CAT: 0127-OR1029903-01Size: 25 gDry Ice: NoHazardous: No
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CAT#:0127-OR1029903-01Size:25 g
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
3468-63-1
Synonyms
1-[ (2,4-dinitrophenyl) diazenyl]naphthalen-2-ol
Purity
90%
Smiles
C1=CC=C2C(=C1)C=CC(=C2N=NC3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-])O

Chemical Information

Fast Orange

D&C Orange No. 17 can cause cancer according to The Food and Drug Administration (FDA).

CAS Number3468-63-1
PubChem CID18981
IUPAC Name1-[(2,4-dinitrophenyl)diazenyl]naphthalen-2-ol
Molecular FormulaC16H10N4O5
Molecular Weight338.27
XLogP4.3
Topological Polar Surface Area137
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count7
Rotatable Bond Count2
Heavy Atom Count25
Formal Charge0
Complexity532
SMILES
C1=CC=C2C(=C1)C=CC(=C2N=NC3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-])O
InChI
InChI=1S/C16H10N4O5/c21-15-8-5-10-3-1-2-4-12(10)16(15)18-17-13-7-6-11(19(22)23)9-14(13)20(24)25/h1-9,21H
InChIKey
HBHZKFOUIUMKHV-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Fast Orange
CAS: 3468-63-1
CID: 18981
Formula: C16H10N4O5
MW: 338.27
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight338.27
XLogP34.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count7
Rotatable Bond Count2
Exact Mass338.06511943
Monoisotopic Mass338.06511943
Topological Polar Surface Area137 Ų
Heavy Atom Count25
Formal Charge0
Complexity532
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