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Lumiflavin

CAT: 0572-TRC-L473900-10MGSize: 10 mgDry Ice: NoHazardous: No
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CAT#:0572-TRC-L473900-10MGSize:10 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
1088-56-8
Hazard Statement
No Data Available
Purity
>95% (HPLC)
Smiles
CN1C2=NC(=O)NC(=O)C2=Nc3cc(C)c(C)cc13
Molecular Formula
C13H12N4O2
Molecular Weight
256.26
Shipping Conditions
Room Temperature
Storage Conditions
+4°C

Chemical Information

Lumiflavin

Lumiflavin is a compound showing yellow-green fluorescence, formed by a photolysis of riboflavin in alkaline solution.

CAS Number1088-56-8
PubChem CID66184
IUPAC Name7,8,10-trimethylbenzo[g]pteridine-2,4-dione
Molecular FormulaC13H12N4O2
Molecular Weight256.26
XLogP1.1
Topological Polar Surface Area74.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count0
Heavy Atom Count19
Formal Charge0
Complexity511
SMILES
CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C
InChI
InChI=1S/C13H12N4O2/c1-6-4-8-9(5-7(6)2)17(3)11-10(14-8)12(18)16-13(19)15-11/h4-5H,1-3H3,(H,16,18,19)
InChIKey
KPDQZGKJTJRBGU-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Lumiflavin
CAS: 1088-56-8
CID: 66184
Formula: C13H12N4O2
MW: 256.26
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight256.26
XLogP31.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count0
Exact Mass256.09602564
Monoisotopic Mass256.09602564
Topological Polar Surface Area74.1 Ų
Heavy Atom Count19
Formal Charge0
Complexity511
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

Alternative Products

CatalogName
015703-01Lumiflavin
453965Lumiflavin-d3
MBS6050597-01Lumiflavin 5-Oxide
VAA22726-01Lumiflavin-3-acetic acid
460362N3-Ethylthiosulfonylmethyl Lumiflavin
453964-01Lumiflavin-13C,15N2
sc-482567N3-Methanethiosulfonylmethyl Lumiflavin
453963-01Lumiflavin N3-Ethyl Bromide
453962-01Lumiflavin N3-Ethyl Alcohol
MBS6024475-01Lumiflavin-3-acetic Acid Ethyl Ester

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