alpha,beta-methylene-dTTP

Base Information

• Chemical Name: alpha,beta-methylene-dTTP
• CAS No.: 24716-71-0
• Molecular Formula: C11H19 N2 O13 P3
• Molecular Weight: 480.2
• ChEMBL ID: CHEMBL1162299
• Pharos Ligand ID: Q9283H7UHMVN
• Mol file: 24716-71-0.mol

Synonyms:alpha beta-CH2-dTTP;alpha,beta-methylenedeoxythymidine 5'-triphosphate

Chemical Property of alpha,beta-methylene-dTTP

Chemical Property:

• PKA: 0.56±0.10(Predicted)
• PSA: 264.34000
• Density: 1.839±0.06 g/cm3(Predicted)
• LogP: -1.05240
• XLogP3: -5.2
• Hydrogen Bond Donor Count: 6
• Hydrogen Bond Acceptor Count: 13
• Rotatable Bond Count: 8
• Exact Mass: 480.00999966
• Heavy Atom Count: 29
• Complexity: 853

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

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MSDS Files:

Useful:

• Canonical SMILES: CC1=CN(C(=O)NC1=O)C2CC(C(O2)COP(=O)(CP(=O)(O)OP(=O)(O)O)O)O
• Isomeric SMILES: CC1=CN(C(=O)NC1=O)[C@H]2C[C@@H]([C@H](O2)COP(=O)(CP(=O)(O)OP(=O)(O)O)O)O

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