5-[(3aS,4S,6aR)-2-Oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl]pentanehydrazide

Basic Information

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CAS Number

66640-86-6

Molecular Formula

C10H18N4O2S

Molecular Weight

258.35 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

Basic Physical Properties

Melting Point

231.0 to 235.0 deg-C

Boiling Point

633.1°C at 760 mmHg

Density

1.243

Flash Point

336.7 °C

Solubility

DMSO: ≤20 mg/mL

Refractive Index

1.553

SMILES

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C1C2C(C(S1)CCCCC(=O)NN)NC(=O)N2

InChI

InChI=1S/C10H18N4O2S/c11-14-8(15)4-2-1-3-7-9-6(5-17-7)12-10(16)13-9/h6-7,9H,1-5,11H2,(H,14,15)(H2,12,13,16)/t6-,7-,9-/m0/s1

InChIKey

KOZWHQPRAOJMBN-ZKWXMUAHSA-N

LogP

-0.2978999999999989

Topological Polar Surface Area

96.25 Å²

Hydrogen Bond Donor/Acceptor

5 / 6

Complexity

313

Safety Information

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Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

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

Sensitiveness

thermally sensitive

Synonyms & References

English

AS-74083
NS00122927
EX-A4437
Probes2_000011
1H-Thieno(3,4-d)imidazole-4-pentanoic acid, hexahydro-2-oxo-, hydrazide, (3aS-(3aalpha,4beta,6aalpha))-
AKOS016009615
J-516038
KOZWHQPRAOJMBN-ZKWXMUAHSA-N
HY-100215
5-[(3aS,4S,6aR)-2-oxo-hexahydro-1H-thieno[3,4-d]imidazol-4-yl]pentanehydrazide
SCHEMBL33865
MFCD00078532
Biotin hydrazide HCl
66640-86-6
(+)-Biotin-hydrazide
1H-THIENO(3,4-D)IMIDAZOLE-4-PENTANOIC ACID, HEXAHYDRO-2-OXO-, HYDRAZIDE, (3AS-(3A.ALPHA.,4.BETA.,6A.ALPHA.))-
biotin hydrazone
BP-22107
5-((3aS,4S,6aR)-2-Oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl)pentanehydrazide
5-((3AS,4S,6aR)-2-Oxohexahydro-1H-thieno-[3,4-d]imidazol-4-yl)pentanehydrazide
UNII-BD4VQ48JNV
CHEMBL4458159
LCZC2370
5-((3aS,4S,6aR)-2-Oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl)pentanehydrazi de
biotin-hydrazide
(+)-Biotin hydrazide
DTXSID50985217
Biotin-NHNH2
(+)-Biotin hydrazide, >=97% (TLC), powder
Biotin hydrazide
1H-Thieno[3,4-d]imidazole-4-pentanoic acid, hexahydro-2-oxo-,hydrazide, (3aS,4S,6aR)-

MDL Number

MFCD00078532

Customs Code

2934999090

FAQ

What regulatory guidelines apply to 5-[(3aS,4S,6aR)-2-Oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl]pentanehydrazide (CAS: 66640-86-6)?

5-[(3aS,4S,6aR)-2-Oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl]pentanehydrazide (CAS 66640-86-6) falls under various regulatory guidelines. It is considered a controlled substance under the Chemical Industry Safety Management Regulations, and it must comply with the REACH regulations for the European market. Additionally, the FDA and EPA have specific requirements for the handling and disposal of this chemical to ensure safe use and minimize environmental impact.

Are there alternatives to 5-[(3aS,4S,6aR)-2-Oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl]pentanehydrazide (CAS: 66640-86-6) in synthesis?

For synthesis, alternatives to 5-[(3aS,4S,6aR)-2-Oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl]pentanehydrazide (CAS 66640-86-6) include other hydrazide compounds such as 2,4-dinitrophenylhydrazine or semicarbazide. These alternatives can serve similar functional roles in various reactions, although their specific applications and compatibility depend on the reaction conditions and desired products.

What is the market or research trend for 5-[(3aS,4S,6aR)-2-Oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl]pentanehydrazide (CAS: 66640-86-6)?

The market and research trends for 5-[(3aS,4S,6aR)-2-Oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl]pentanehydrazide (CAS 66640-86-6) are focused on its applications in pharmaceuticals and agrochemicals. Recent research indicates an increasing interest in its potential as a therapeutic agent for various diseases due to its unique chemical structure. Market trends suggest a growing demand as more studies validate its biological activity and safety profiles.

How should waste containing 5-[(3aS,4S,6aR)-2-Oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl]pentanehydrazide (CAS: 66640-86-6) be handled?

Waste containing 5-[(3aS,4S,6aR)-2-Oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl]pentanehydrazide (CAS 66640-86-6) should be collected and stored in a sealed container to prevent environmental contamination. It is crucial to follow local waste disposal regulations. For large quantities, professional waste disposal services should be utilized. Additionally, proper incineration or chemical neutralization methods should be considered to ensure the safe and environmentally friendly disposal of this waste material.