Structure

Lumichrome

CAS
1086-80-2
Catalog Number
ACM1086802
Category
Other Products
Molecular Weight
242.23
Molecular Formula
C12H10N4O2

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Specification

Synonyms
7,8-Dimethylbenzo[g]pteridine-2,4-diol
InChI
InChI=1S/C12H10N4O2/c1-5-3-7-8(4-6(5)2)14-10-9(13-7)11(17)16-12(18)15-10/h3-4H,1-2H3,(H2,14,15,16,17,18)
InChI Key
ZJTJUVIJVLLGSP-UHFFFAOYSA-N
Melting Point
300 °C
Complexity
386
Covalently-Bonded Unit Count
1
Defined Atom Stereocenter Count
0
Exact Mass
242.08037557
Heavy Atom Count
18
Hydrogen Bond Acceptor Count
4
Hydrogen Bond Donor Count
2
Monoisotopic Mass
242.08037557
Physical State
Powder
Rotatable Bond Count
0
Safety Description
24/25
Topological Polar Surface Area
84 Ų
What is the PubChem CID of Lumichrome?

The PubChem CID of Lumichrome is 5326566.

What is the molecular formula of Lumichrome?

The molecular formula of Lumichrome is C12H10N4O2.

What is the molecular weight of Lumichrome?

The molecular weight of Lumichrome is 242.23 g/mol.

What is the IUPAC name of Lumichrome?

The IUPAC name of Lumichrome is 7,8-dimethyl-1H-benzo[g]pteridine-2,4-dione.

What is the InChI of Lumichrome?

The InChI of Lumichrome is InChI=1S/C12H10N4O2/c1-5-3-7-8(4-6(5)2)14-10-9(13-7)11(17)16-12(18)15-10/h3-4H,1-2H3,(H2,14,15,16,17,18).

What is the InChIKey of Lumichrome?

The InChIKey of Lumichrome is ZJTJUVIJVLLGSP-UHFFFAOYSA-N.

What is the canonical SMILES of Lumichrome?

The canonical SMILES of Lumichrome is CC1=CC2=C(C=C1C)N=C3C(=N2)C(=O)NC(=O)N3.

What is the CAS number of Lumichrome?

The CAS number of Lumichrome is 1086-80-2.

What is the ChEBI ID of Lumichrome?

The ChEBI ID of Lumichrome is CHEMBL1234101.

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