ethyl (1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)acetate

Base Information

• Chemical Name: ethyl (1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)acetate
• CAS No.: 7029-96-1
• Molecular Formula: C11H14N4O4
• Molecular Weight: 266.257
• DSSTox Substance ID: DTXSID601031913
• Nikkaji Number: J401.160K
• ChEMBL ID: CHEMBL85644
• Mol file: 7029-96-1.mol

Synonyms:7029-96-1;ethyl (1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)acetate;ethyl 2-(1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-7-yl)acetate;Ethyl 2-(1,3-dimethyl-2,6-dioxo-2,3-dihydro-1H-purin-7(6H)-yl)acetate;Oprea1_223904;Oprea1_591469;CHEMBL85644;ethyl 2-(1,3-dimethyl-2,6-dioxopurin-7-yl)acetate;SCHEMBL12260494;DTXSID601031913;STK134564;AKOS000576487;NCGC00284687-01;CS-0331296;AB01289347-01;Ethyl (1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydropurin-7-yl)acetate;Ethyl 2-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)acetate

Chemical Property of ethyl (1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)acetate

Chemical Property:

• XLogP3: -0.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 4
• Exact Mass: 266.10150494
• Heavy Atom Count: 19
• Complexity: 414

Purity/Quality:

NLT 98% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCOC(=O)CN1C=NC2=C1C(=O)N(C(=O)N2C)C