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Sudan II

CAT: 0572-TRC-S688890-500MGSize: 500 mgDry Ice: NoHazardous: No
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CAT#:0572-TRC-S688890-500MGSize:500 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
3118-97-6
Hazard Statement
Causes skin irritation
Purity
>95% (HPLC)
Smiles
Cc1ccc(N=Nc2c(O)ccc3ccccc23)c(C)c1
Molecular Formula
C18 H16 N2 O
Molecular Weight
276.33
InChI
InChI=1S/C18H16N2O/c1-12-7-9-16(13(2)11-12)19-20-18-15-6-4-3-5-14(15)8-10-17(18)21/h3-11,21H,1-2H3/b20-19+
Additionnal Information
IUPAC name: 1-[(E)-(2,4-dimethylphenyl)diazenyl]naphthalen-2-ol
Shipping Conditions
Room Temperature
Storage Conditions
+4°C

Chemical Information

Sudan II

Sudan II is a member of azobenzenes.

CAS Number3118-97-6
PubChem CID18386
IUPAC Name1-[(2,4-dimethylphenyl)diazenyl]naphthalen-2-ol
Molecular FormulaC18H16N2O
Molecular Weight276.3
XLogP5.3
Topological Polar Surface Area45
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Heavy Atom Count21
Formal Charge0
Complexity370
SMILES
CC1=CC(=C(C=C1)N=NC2=C(C=CC3=CC=CC=C32)O)C
InChI
InChI=1S/C18H16N2O/c1-12-7-9-16(13(2)11-12)19-20-18-15-6-4-3-5-14(15)8-10-17(18)21/h3-11,21H,1-2H3
InChIKey
JBTHDAVBDKKSRW-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Sudan II
CAS: 3118-97-6
CID: 18386
Formula: C18H16N2O
MW: 276.3
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight276.3
XLogP35.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Exact Mass276.126263138
Monoisotopic Mass276.126263138
Topological Polar Surface Area45 Ų
Heavy Atom Count21
Formal Charge0
Complexity370
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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