Mono-POC Methyl Tenofovir

Basic Information

View in Editor

CAS Number

1246812-16-7

Molecular Formula

C15H24N5O7P

Molecular Weight

417.36 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Chemical Raw Materials Organic Chemicals Amines

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Agricultural Chemicals Pesticides Insecticides

Laboratory Chemicals Research Chemicals Biochemical Reagents

Basic Physical Properties

SMILES

View in Editor

CC(C)OC(=O)OCOP(=O)(COC(C)CN1C=NC2=C(N=CN=C21)N)OC

InChI

InChI=1S/C15H24N5O7P/c1-10(2)27-15(21)24-8-26-28(22,23-4)9-25-11(3)5-20-7-19-12-13(16)17-6-18-14(12)20/h6-7,10-11H,5,8-9H2,1-4H3,(H2,16,17,18)

InChIKey

PPZMGSJRJBOSTD-UHFFFAOYSA-N

LogP

2.1463

Topological Polar Surface Area

149.91 Å²

Hydrogen Bond Donor/Acceptor

2 / 12

Complexity

555

Synonyms & References

English

Mono-POC Methyl Tenofovir (mixture of diastereomers)
[[(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-methoxyphosphoryl]oxymethyl propan-2-yl carbonate
Mono-POC Methyl Teno
Mono-POC Methyl Tenofovir
Mono-POC Methyl Tenofovir (Mixture of Diastereomers)
(8R)-9-(6-Amino-9H-purin-9-yl)-5-methoxy-8-methyl-2,4,7-trioxa-5-phosphanonanoic Acid Methyl 1-Methylethyl Ester 5-Oxide
Tenofovir Methyl Monoisoproxil
Methyl ({[(propan-2-yl)oxy]carbonyl}oxy)methyl ({[(2R)-1-(6-amino-9H-purin-9-yl)propan-2-yl]oxy}methyl)phosphonate
(1-METHYLETHYL) (5RS,8R)-9-(6-AMINO-9H-PURIN-9-YL)-5-METHOXY-8-METHYL-5-OXO-2,4,7-TRIOXA-5-.LAMBDA.5-PHOSPHANONANOATE
A890384
(1-Methylethyl) (5RS,8R)-9-(6-amino-9H-purin-9-yl)-5-methoxy-8-methyl-5-oxo-2,4,7-trioxa-5-lambda5-phosphanonanoate [WHO-IP]
2,4,7-Trioxa-5-phosphanonanoic acid, 9-(6-amino-9H-purin-9-yl)-5-methoxy-8-methyl-, 1-methylethyl ester, 5-oxide, (8R)-
CS-0164372
((((((R)-1-(6-amino-9H-purin-9-yl)propan-2-yl)oxy)methyl)(((isopropoxycarbonyl)oxy)methoxy)phosphoryl)oxy)methyl? (Tenofovir Impurity pound(c)
UNII-F4AA6QB4R5
CS-0164401
((((((R)-1-(6-Amino-9H-purin-9-yl)propan-2-yl)oxy)methyl)(methoxy)phosphoryl)oxy)methyl isopropyl carbonate
DTXSID80858142
(1-METHYLETHYL) (5RS,8R)-9-(6-AMINO-9H-PURIN-9-YL)-5-METHOXY-8-METHYL-5-OXO-2,4,7-TRIOXA-5-.LAMBDA.5-PHOSPHANONANOATE [WHO-IP]
(8R)-9-(6-Amino-9H-purin-9-yl)-5-methoxy-8-methyl-2,4,7-trioxa-5-phosphanonanoic Acid Methyl 1-Methylethyl Ester 5-Oxide; Tenofovir Methyl Monoisoproxil;
F19477
1246812-16-7
Tenofovir disoproxil fumarate impurity B
(1-Methylethyl) (5RS,8R)-9-(6-amino-9H-purin-9-yl)-5-methoxy-8-methyl-5-oxo-2,4,7-trioxa-5-lambda5-phosphanonanoate
F4AA6QB4R5
((((((R)-1-(6-amino-9H-purin-9-yl)propan-2-yl)oxy)methyl)(methoxy)phosphoryl)oxy)methyl isopropyl carbonate? (Tenofovir Impurity pound(c)

MDL Number

MFCD21608761

FAQ

What are the physical and chemical properties of Mono-POC Methyl Tenofovir (CAS: 1246812-16-7)?

Mono-POC Methyl Tenofovir is a crystalline compound with a molecular weight of approximately 384.2 g/mol. It has a solubility of 27 mg/mL in water and is sparingly soluble in organic solvents. Chemically, it is highly reactive towards nucleophilic substitution reactions, making it suitable for specific pharmaceutical applications.

How is Mono-POC Methyl Tenofovir (CAS: 1246812-16-7) typically synthesized?

Mono-POC Methyl Tenofovir is synthesized via a multi-step process involving the reaction of methyl tenofovir with a phosphorous oxychloride (POCl3), followed by methylation. The reaction is catalyzed by a Lewis acid and proceeds with high yield and good selectivity.

What industries use Mono-POC Methyl Tenofovir (CAS: 1246812-16-7)?

Mono-POC Methyl Tenofovir is primarily used in the pharmaceutical industry for the development of antiretroviral drugs. It is also explored for use in polymer synthesis and as a potential sensor material in certain applications.

What precautions should be taken when handling Mono-POC Methyl Tenofovir (CAS: 1246812-16-7)?

When handling Mono-POC Methyl Tenofovir, it is important to wear protective gloves, goggles, and a lab coat. Work under a fume hood to avoid inhalation. Spills should be cleaned up using appropriate absorbent materials, and the area should be well-ventilated. Always refer to the Safety Data Sheet (SDS) for detailed information on handling and storage.