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2-Amino-9-[(4aR,6R,7R,7aS)-2,7-dihydroxy-2-oxidotetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-6-yl]-1,9-dihydro-6H-purin-6-one(CAS: 7665-99-8)

2-Amino-9-[(4aR,6R,7R,7aS)-2,7-dihydroxy-2-oxidotetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-6-yl]-1,9-dihydro-6H-purin-6-one
CAS Number

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Basic Information

Molecular Formula
C10H12N5O7P
Molecular Weight
345.21 g/mol

Physical Properties

Boiling Point
792.7°C at 760 mmHg
Density
2.64
Flash Point
433.2°C

Chemical Identifiers

SMILES
C1C2C(C(C(O2)N3C=NC4=C3N=C(NC4=O)N)O)OP(=O)(O1)O
InChIKey
ZOOGRGPOEVQQDX-UUOKFMHZSA-N

Database References

MDL Number
MFCD00070129

FAQ

The compound is a crystalline solid with a molecular weight of approximately 453.18 g/mol. It is slightly soluble in water and more soluble in polar solvents like ethanol and acetonitrile. Chemically, it is reactive towards nucleophiles, particularly amino groups and hydroxyl groups. It exhibits acidic and basic properties typical of purines and phosphorus-containing compounds.
This compound is typically synthesized via multistep organic synthesis routes using protected purine derivatives and phosphorus-containing intermediates. Key steps involve protection of functional groups, ring formation, and deprotection. Catalysts such as palladium(II) acetate and bases like cesium carbonate are often used. The overall yield is moderate, around 50-60%, with high selectivity for the desired product.
This compound is primarily used in pharmaceuticals for the development of novel therapeutics. It also finds applications in the synthesis of advanced materials, such as polymers and semiconductors, where its unique chemical structure is utilized. Additionally, it can be used in the fabrication of sensors due to its reactivity and specific functional groups.
When handling this compound, it is important to wear appropriate personal protective equipment (PPE) such as gloves, goggles, and a lab coat. Ensure laboratory fume hoods are used during operations to minimize inhalation risk. Spills should be cleaned up with mild acids or bases, and the site should be well-ventilated. Always refer to the safety data sheet (SDS) for specific instructions and emergency procedures.

Safety Notice

Please verify product specifications and safety data before use. Contact the supplier for detailed safety information.

Always follow proper handling procedures

Contact Information

Contact Person

Wang Yong

Email

1735692241@qq.com

Mobile

18211026772

Telephone

010-59412420

Address

No. 1016, Building C, Shangke Office Community, No. 58 Dongdaqing West Road, Haidian District, Beijing