Azacitidine USP Related Compound B

Basic Information

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CAS Number

6974-32-9

Molecular Formula

C28H24O9

Molecular Weight

504.49 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Esters

Basic Chemical Raw Materials Organic Chemicals Ethers

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

127.0 to 132.0 deg-C

Boiling Point

621°C at 760 mmHg

Density

1.3510

Flash Point

>110°(230°F)

Refractive Index

24 ° (C=1, Pyridine)

Specific Rotation

24.4 º (c=1, pyridine)

SMILES

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CC(=O)OC1C(C(C(O1)COC(=O)C2=CC=CC=C2)OC(=O)C3=CC=CC=C3)OC(=O)C4=CC=CC=C4

InChI

InChI=1S/C28H24O9/c1-18(29)34-28-24(37-27(32)21-15-9-4-10-16-21)23(36-26(31)20-13-7-3-8-14-20)22(35-28)17-33-25(30)19-11-5-2-6-12-19/h2-16,22-24,28H,17H2,1H3/t22-,23-,24-,28-/m1/s1

InChIKey

GCZABPLTDYVJMP-CBUXHAPBSA-N

LogP

3.582600000000002

Topological Polar Surface Area

114.43 Å²

Hydrogen Bond Donor/Acceptor

0 / 9

Complexity

794

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

AS-13409
beta-D-Ribofuranose, 1-acetate 2,3,5-tribenzoate
Acetyl-tribenzoyl-.beta.-d-ribofuranose
beta-D-Ribofuranose,1-acetate 2,3,5-tribenzoate
1-Acetyl-2,3,5-tribenzoyl-beta-D-ribofuranose
1-O-Acetyl-2,3,5-O-benzoyl-.beta.-d-ribofuranose
beta-D-Ribofuranose 1-acetate 2,3,5-tribenzoate, 98%
1-ACETYL-2,3,5-TRIBENZOY-B-D-RIBOFURANOSE
(2S,3R,4R,5R)-2-Acetoxy-5-((benzoyloxy)methyl)tetrahydrofuran-3,4-diyl dibenzoate
1-O-acetyl-2,3,5-tri-O-benzoyl beta-D-ribofuranose
1-O-Acetyl-2,3,5-tri-O-benzoyl-.beta.-D-ribofuranose
1-Acetyl-2,3,5-tribenzoyl-.beta.-D-ribofuranose
1-O-acetyl-2,3,5-tri-O-benzoyl-beta-D-ribose
AKOS015889645
EINECS 230-220-4
1-O-Acetyl-2,3,5-tri-O-benzoyl- beta -D-ribofuranose
Ribofuranose, 1-acetate 2,3,5-tribenzoate, beta-D-
Ribofuranose, 1-acetate 2,3,5-tribenzoate, .beta.-D-
NSC 23349
AC-4270
F16262
NS00043809
(2S,3R,4R,5R)-2-acetoxy-5-(benzoyloxymethyl)tetrahydrofuran-3,4-diyl dibenzoate
CS-W007928
1-o-acetyl-2,3,5-tri-o-benzoylbeta-d-ribofuranose
6974-32-9
1-O-Acetyl-2,3,5-tri-O-benzoylpentofuranose #
1-O-Acetyl-2,3,5-tri-O-benzoyl-beta-D-ribofuranose
[(2R,3R,4R,5S)-5-(acetyloxy)-3,4-bis(benzoyloxy)oxolan-2-yl]methyl benzoate
1-O-Acetyl-2,3,5-tri-O-benzoyl-b-D-ribofuranose
1-O-Acetyl-2,3,5-tri-O-benzoyl-?-D-ribofuranose

MDL Number

MFCD00005357

FAQ

What is Azacitidine USP Related Compound B (CAS: 6974-32-9)?

Azacitidine USP Related Compound B, with the CAS number 6974-32-9, is a synthetic compound used primarily as an impurity or related substance in the production of azacitidine. It has a chemical formula of C9H13N3O2 and is typically a white to off-white crystalline solid. This compound is known for its structural similarity to azacitidine and exhibits similar pharmacological properties, though it is not intended for therapeutic use.

What are the main uses of Azacitidine USP Related Compound B (CAS: 6974-32-9)?

Azacitidine USP Related Compound B (CAS: 6974-32-9) is mainly used in pharmaceutical quality control and research settings to identify and quantify impurities in azacitidine formulations. It plays a role in drug development processes, ensuring purity and consistency. Additionally, it may be used in analytical studies for method validation and as a reference standard in chemical testing.

Is Azacitidine USP Related Compound B (CAS: 6974-32-9) safe?

Azacitidine USP Related Compound B (CAS: 6974-32-9) is generally considered safe when handled properly in controlled laboratory environments. However, as with many chemical compounds, it should be treated with caution. Safety data sheets recommend wearing protective gloves, goggles, and a lab coat to prevent skin and eye contact. It is important to follow standard safety protocols when working with this substance to minimize exposure risks.

How should Azacitidine USP Related Compound B (CAS: 6974-32-9) be stored?

Azacitidine USP Related Compound B (CAS: 6974-32-9) should be stored in a cool, dry, and well-ventilated place, away from direct light. It is typically kept in a sealed container to maintain stability and prevent contamination. The recommended storage temperature is between 2°C to 8°C, and it should be protected from moisture to preserve its chemical integrity.