Tenofovir Impurity 122 (Isopentenyl-Adenine)

Basic Information

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CAS Number

2365-40-4

Molecular Formula

C10H13N5

Molecular Weight

203.25 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Dyes and Pigments Organic Dyes

Basic Physical Properties

Boiling Point

318.8°C at 760 mmHg

Density

1.266g/cm3

Flash Point

242.4ºC

Refractive Index

1.659

SMILES

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CC(=CCNC1=NC=NC2=C1NC=N2)C

InChI

InChI=1S/C10H13N5/c1-7(2)3-4-11-9-8-10(13-5-12-8)15-6-14-9/h3,5-6H,4H2,1-2H3,(H2,11,12,13,14,15)

InChIKey

HYVABZIGRDEKCD-UHFFFAOYSA-N

LogP

1.7309999999999999

Topological Polar Surface Area

66.49000000000001 Å²

Hydrogen Bond Donor/Acceptor

2 / 5

Complexity

236

Safety Information

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Hazard Statement

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Synonyms & References

English

DB08768
N-(3-METHYLBUT-2-EN-1-YL)-9H-PURIN-6-AMINE
N-(.DELTA.2-Isopentenyl)adenine
N6-(2-Isopentenyl)-adenine;6-(gamma,gamma-Dimethylallylamino)purine
A,
D-4760
Q569031
HY-112103
Isopentenyladenine
6-(gamma,gamma-Dimethylallylamino)purine, BioReagent, plant cell culture tested, >=98.5%
N(6)-(.DELTA.2-Isopentenyl)aminopurine
N6-(3-Methyl-2-butenyl)adenine
IPADE
NSC106958
2-IP
NCIStruc2_000921
6-(gamma,gamma-Dimethylallylamino)purine, BioReagent, plant cell culture tested, >=90%
6-(,-Dimethylallylamino)purine
N-(3-Methyl-2-butenyl)adenine
CHEBI:17660
FT-0629731
6-(3,3-DIMETHYLALLYLAMINO)PURINE
NCI106958
N-(3-Methyl-2-butenyl)-1H-purin-6-amine #
NSC 106958
A816825
CHEMBL476189
2365-40-4
AC-15608
N-(3-methylbut-2-enyl)-7H-purin-6-amine
Oprea1_344117

MDL Number

MFCD00132998

Customs Code

2934993000

FAQ

What is Tenofovir Impurity 122 (Isopentenyl-Adenine) (CAS: 2365-40-4)?

Tenofovir Impurity 122, also known as Isopentenyl-Adenine, is a nucleoside analog with the chemical formula C10H13N5O4P. It is a white crystalline powder, highly soluble in water, and commonly used as an impurity in the synthesis of tenofovir. Its structure resembles adenosine but features an isopentenyl group instead of a ribose sugar, making it relevant in pharmaceutical research and drug purity analysis.

What are the main uses of Tenofovir Impurity 122 (Isopentenyl-Adenine) (CAS: 2365-40-4)?

Tenofovir Impurity 122 (Isopentenyl-Adenine) is primarily used in pharmaceutical research to study impurity profiles during the production of antiretroviral drugs like tenofovir. It also serves as a precursor in the synthesis of nucleoside analogs and is employed in analytical chemistry for quality control in drug manufacturing. Additionally, it is relevant in biochemical studies related to nucleotide metabolism and enzyme activity.

Is Tenofovir Impurity 122 (Isopentenyl-Adenine) (CAS: 2365-40-4) safe?

Tenofovir Impurity 122 (Isopentenyl-Adenine) is not intended for human or animal use and should be handled with care in laboratory settings. While specific toxicity data may be limited, standard safety precautions include wearing gloves, goggles, and ensuring adequate ventilation. It is classified under controlled chemical handling protocols, and safety standards emphasize avoiding exposure through proper containment and disposal practices.

How should Tenofovir Impurity 122 (Isopentenyl-Adenine) (CAS: 2365-40-4) be stored?

Tenofovir Impurity 122 (Isopentenyl-Adenine) should be stored in a cool, dry, and dark place, ideally at 2-8°C, to maintain stability. It requires airtight containers to prevent moisture absorption and degradation. Avoid exposure to light and humidity, and ensure storage in a well-ventilated area. Keep away from incompatible substances and follow proper labeling for safe handling.