Abacavir Sulphate

Basic Information

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CAS Number

136777-48-5

Molecular Formula

C28H38N12O6S

Molecular Weight

670.74 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

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

Laboratory Chemicals Research Chemicals Biochemical Reagents

Basic Physical Properties

Melting Point

232-237°C

SMILES

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C1CC1NC2=NC(=NC3=C2N=CN3C4CC(C=C4)CO)N.C1CC1NC2=NC(=NC3=C2N=CN3C4CC(C=C4)CO)N.OS(=O)(=O)O

InChI

InChI=1S/2C14H18N6O.H2O4S/c2*15-14-18-12(17-9-2-3-9)11-13(19-14)20(7-16-11)10-4-1-8(5-10)6-21;1-5(2,3)4/h2*1,4,7-10,21H,2-3,5-6H2,(H3,15,17,18,19);(H2,1,2,3,4)

InChIKey

WMHSRBZIJNQHKT-UHFFFAOYSA-N

LogP

1.5318000000000014

Topological Polar Surface Area

278.36 Å²

Hydrogen Bond Donor/Acceptor

10 / 18

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

Abacavir
Ziagen
1592U89
ABC
2-Cyclopentene-1-methanol,4-[2-a-mino-6-(cyclopropylamino)-9H-purin-9-yl]-,(1S,4R)
[(4S)-4-[2-amino-6-(cyclopropylamino)purin-9-yl]cyclopenten-1-yl]methanol,sulfuric acid
FT-0606626
(1S-cis)-4-[2-Amino-6-(cyclopropylamino)-9H-purin-9-yl]-2-cyclopentene-1-methanol monohydrochloride
Abacavir hydrochloride

MDL Number

MFCD18427212

FAQ

What regulatory guidelines apply to Abacavir Sulphate (CAS: 136777-48-5)?

Abacavir Sulphate (CAS: 136777-48-5) must comply with regulatory guidelines such as the Globally Harmonized System (GHS) for classification and labeling of chemicals, REACH regulations for EU market, and FDA guidelines for pharmaceutical usage. EPA regulations may also apply, especially concerning environmental protection measures during production and disposal.

Are there alternatives to Abacavir Sulphate (CAS: 136777-48-5) in synthesis?

Alternatives to Abacavir Sulphate (CAS: 136777-48-5) in synthesis include other nucleoside analogs like zidovudine or tenofovir, which can serve similar antiviral purposes. Common alternative reagents and processes may vary based on the specific requirements of the synthesis, such as using different solvents or catalysts.

What is the market or research trend for Abacavir Sulphate (CAS: 136777-48-5)?

The market for Abacavir Sulphate (CAS: 136777-48-5) is stable, with a focus on controlled drug supplies and treatment of HIV. Research trends include the development of combination therapies and the exploration of abacavir-based compounds for broader applications. Price trends may vary based on supply and demand, with the trend showing a steady but sometimes fluctuating market.

How should waste containing Abacavir Sulphate (CAS: 136777-48-5) be handled?

Waste containing Abacavir Sulphate (CAS: 136777-48-5) should be collected in appropriate containers and disposed of through professional waste disposal services. Incineration may be necessary for complete destruction, and environmental protection precautions must be followed to prevent contamination. Compliance with local and national regulations is essential throughout the waste handling process.