AOD 9604 | CAS No. 221231-10-3

AOD 9604

Basic Information

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CAS Number

221231-10-3

Molecular Formula

C78H123N23O23S2

Molecular Weight

1815.08 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

SMILES

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CCC(C(C(=O)NC(C(=O)NC(C(=O)NC1CSSCC(NC(=O)C(CO)NC(=O)CNC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(NC1=O)CCCNC(=N)N)CO)C(C)C)CCC(=O)O)C(=O)NCC(=O)NC(C(=O)O)Cc1ccccc1)CCC(=O)N)C(C)C)NC(=O)C(NC(=O)C(NC(=O)C(Cc1ccc(cc1)O)N)CC(C)C)CCCNC(=N)N)C

InChI

InChI=1S/C78H123N23O23S2/c1-9-41(8)62(101-68(115)47(18-14-28-86-78(83)84)91-69(116)50(29-38(2)3)95-63(110)45(79)30-43-19-21-44(104)22-20-43)75(122)100-61(40(6)7)74(121)94-49(23-25-56(80)105)67(114)98-55-37-126-125-36-54(65(112)88-32-57(106)89-51(76(123)124)31-42-15-11-10-12-16-42)97-70(117)52(34-102)90-58(107)33-87-64(111)48(24-26-59(108)109)93-73(120)60(39(4)5)99-71(118)53(35-103)96-66(113)46(92-72(55)119)17-13-27-85-77(81)82/h10-12,15-16,19-22,38-41,45-55,60-62,102-104H,9,13-14,17-18,23-37,79H2,1-8H3,(H2,80,105)(H,87,111)(H,88,112)(H,89,106)(H,90,107)(H,91,116)(H,92,119)(H,93,120)(H,94,121)(H,95,110)(H,96,113)(H,97,117)(H,98,114)(H,99,118)(H,100,122)(H,101,115)(H,108,109)(H,123,124)(H4,81,82,85)(H4,83,84,86)

InChIKey

GVIYUKXRXPXMQM-UHFFFAOYSA-N

LogP

-7.435259999999945

Topological Polar Surface Area

764.6999999999999 Å²

Hydrogen Bond Donor/Acceptor

32 / 46

Complexity

3710

Synonyms & References

English

AOD 9604
7UP768IP4M
AOD9604
Unii-7UP768IP4M
AOD-9604

FAQ

What regulatory guidelines apply to AOD 9604 (CAS: 221231-10-3)?

AOD 9604 (CAS: 221231-10-3) falls under the scope of the Globally Harmonized System of Classification and Labelling of Chemicals (GHS). It is also subject to the European Union REACH regulations, which require manufacturers and importers to register chemicals above a certain tonnage threshold. In the United States, the EPA and FDA may have specific requirements related to the handling, storage, and use of this compound.

Are there alternatives to AOD 9604 (CAS: 221231-10-3) in synthesis?

While AOD 9604 (CAS: 221231-10-3) offers unique properties, there are alternative reagents that can be used in synthesis. These include other amines and amine derivatives that provide similar functionality. Researchers often explore these alternatives to optimize reaction conditions, improve yield, or address specific safety concerns.

What is the market or research trend for AOD 9604 (CAS: 221231-10-3)?

The market for AOD 9604 (CAS: 221231-10-3) is growing due to its versatile applications in pharmaceuticals and agrochemicals. Research trends indicate a focus on developing new formulations and processes that leverage its reactivity. Additionally, there is increasing interest in sustainable and eco-friendly alternatives, which are driving innovation in its use and synthesis.

How should waste containing AOD 9604 (CAS: 221231-10-3) be handled?

Waste containing AOD 9604 (CAS: 221231-10-3) should be collected in appropriate containers and stored separately to prevent contamination. Proper incineration or professional waste disposal services should be utilized. Environmental protection measures include ensuring that any waste is handled in accordance with local and international regulations to minimize environmental impact.