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Solvent Red 1

CAT: 1489-S4290-02Size: 25 gDry Ice: NoHazardous: No
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CAT#:1489-S4290-02Size:25 g
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CAS Number
1229-55-6
Purity
0.95

Chemical Information

Sudan R

See also: Solvent Red 1 (annotation moved to).

CAS Number1229-55-6
PubChem CID14678
IUPAC Name1-[(2-methoxyphenyl)diazenyl]naphthalen-2-ol
Molecular FormulaC17H14N2O2
Molecular Weight278.30
XLogP4.6
Topological Polar Surface Area54.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count3
Heavy Atom Count21
Formal Charge0
Complexity361
SMILES
COC1=CC=CC=C1N=NC2=C(C=CC3=CC=CC=C32)O
InChI
InChI=1S/C17H14N2O2/c1-21-16-9-5-4-8-14(16)18-19-17-13-7-3-2-6-12(13)10-11-15(17)20/h2-11,20H,1H3
InChIKey
ALLOLPOYFRLCCX-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Sudan R
CAS: 1229-55-6
CID: 14678
Formula: C17H14N2O2
MW: 278.30
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight278.30
XLogP34.6
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count3
Exact Mass278.105527694
Monoisotopic Mass278.105527694
Topological Polar Surface Area54.2 Ų
Heavy Atom Count21
Formal Charge0
Complexity361
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