Ethyl (4R)-5-(4-biphenylyl)-2-methyl-4-({[(2-methyl-2-propanyl)oxy]carbonyl}amino)-2-pentenoate

Basic Information

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CAS Number

149709-59-1

Molecular Formula

C25H31NO4

Molecular Weight

409.53 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

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Basic Physical Properties

Boiling Point

562.7±50.0°C at 760 mmHg

Solubility

Insuluble (2.1E-3 g/L) (25 ºC),

SMILES

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CCOC(=O)C(=C[C@@H](Cc1ccc(cc1)c2ccccc2)NC(=O)OC(C)(C)C)C

InChI

InChI=1S/C25H31NO4/c1-6-29-23(27)18(2)16-22(26-24(28)30-25(3,4)5)17-19-12-14-21(15-13-19)20-10-8-7-9-11-20/h7-16,22H,6,17H2,1-5H3,(H,26,28)/t22-/m0/s1

InChIKey

QOCQMJHAWNNWAV-QFIPXVFZSA-N

LogP

5.298800000000005

Topological Polar Surface Area

64.63 Å²

Hydrogen Bond Donor/Acceptor

1 / 5

Complexity

578

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

Synonyms & References

English

2-?Pentenoic acid, 5-?[1,?1'-?biphenyl]?-?4-?yl-?4-?[[(1,?1-?dimethylethoxy)?carbonyl]?amino]?-?2-?methyl-?, ethyl ester, (4R)?-
(R)-Ethyl 5-([1,1'-biphenyl]-4-yl)-4-((tert-butoxycarbonyl)amino)-2-methylpent-2-enoate
(R,E)-ETHYL 5-([1,1'-BIPHENYL]-4-YL)-4-((TERT-BUTOXYCARBONYL)AMINO)-2-METHYLPENT-2-ENOATE
2-Pentenoic acid, 5-[1,1'-biphenyl]-4-yl-4-[[(1,1-dimethylethoxy)carbonyl]amino]-2-methyl-, ethyl ester, (4R)-
ethyl 5-(4-[1,1'-biphenyl]yl)-4-[[(1,1-dimethylethoxy)carbonyl]amino]-2-methyl-2-pentenoate
(4R)-5-[1,1'-Biphenyl]-4-yl-4-[[(1,1-dimethylethoxy)carbonyl]amino]-2-methyl-2-pentenoic acid ethyl ester
2-Pentenoic acid, 5-[1,1'-biphenyl]-4-yl-4-[[(1,1-dimethylethoxy)carbonyl]amino]-2-methyl-, ethyl ester, (4R)-
ethyl 5-(4-<1,1'-biphenyl>yl)-4-<<(1,1-dimethylethoxy)carbonyl>amino>-2-methyl-2-pentenoate
(R,E)-Ethyl 5-((1,1'-biphenyl)-4-yl)-4-((tert-butoxycarbonyl)amino)-2-methylpent-2-enoate
AMBZ

MDL Number

MFCD23378892

FAQ

What regulatory guidelines apply to Ethyl (4R)-5-(4-biphenylyl)-2-methyl-4-({[(2-methyl-2-propanyl)oxy]carbonyl}amino)-2-pentenoate (CAS: 149709-59-1)?

Ethyl (4R)-5-(4-biphenylyl)-2-methyl-4-({[(2-methyl-2-propanyl)oxy]carbonyl}amino)-2-pentenoate (CAS: 149709-59-1) falls under multiple regulatory frameworks. It is subject to GHS classification, which categorizes it based on its physical, health, and environmental hazards. Additionally, it must comply with REACH regulations for the European market, ensuring that it does not pose an unacceptable risk to human health or the environment. In the United States, it is also subject to FDA and EPA guidelines, particularly in relation to safety and environmental impact.

Are there alternatives to Ethyl (4R)-5-(4-biphenylyl)-2-methyl-4-({[(2-methyl-2-propanyl)oxy]carbonyl}amino)-2-pentenoate in synthesis?

There are several alternatives to Ethyl (4R)-5-(4-biphenylyl)-2-methyl-4-({[(2-methyl-2-propanyl)oxy]carbonyl}amino)-2-pentenoate for synthesis. Researchers often consider using related analogs, such as other substituted pentenoates or isomers. Common alternative reagents include different protecting groups or modified reactants. These alternatives can offer similar functionality while potentially simplifying the synthesis process or reducing the environmental impact.

What is the market or research trend for Ethyl (4R)-5-(4-biphenylyl)-2-methyl-4-({[(2-methyl-2-propanyl)oxy]carbonyl}amino)-2-pentenoate (CAS: 149709-59-1)?

The market for Ethyl (4R)-5-(4-biphenylyl)-2-methyl-4-({[(2-methyl-2-propanyl)oxy]carbonyl}amino)-2-pentenoate (CAS: 149709-59-1) is closely tied to its applications in pharmaceuticals and specialty chemicals. Research trends indicate a growing demand for more efficient synthesis methods and the development of safer, greener alternatives. Market analysts predict an increase in the use of this compound due to its unique properties and its potential in various industries, including drug discovery and material science.

How should waste containing Ethyl (4R)-5-(4-biphenylyl)-2-methyl-4-({[(2-methyl-2-propanyl)oxy]carbonyl}amino)-2-pentenoate (CAS: 149709-59-1) be handled?

Waste containing Ethyl (4R)-5-(4-biphenylyl)-2-methyl-4-({[(2-methyl-2-propanyl)oxy]carbonyl}amino)-2-pentenoate (CAS: 149709-59-1) should be handled with caution to ensure safety and compliance with environmental regulations. Waste liquids should be collected and stored in appropriate containers, labeled with the correct hazard information. For disposal, the waste should be incinerated or treated by a professional hazardous waste disposal service. Environmental protection measures include proper containment to prevent leaks and spills, and adherence to local and international environmental standards.

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Ethyl (4R)-5-(4-biphenylyl)-2-methyl-4-({[(2-methyl-2-propanyl)oxy]carbonyl}amino)-2-pentenoate | CAS No. 149709-59-1

Basic Information

CAS Number

Molecular Formula

Molecular Weight

Chemical Classification

Basic Physical Properties

Boiling Point

Solubility

Chemical Properties

SMILES

InChI

InChIKey

LogP

Topological Polar Surface Area

Hydrogen Bond Donor/Acceptor

Complexity

Safety Information

Hazard Statement

Synonyms & References

English

MDL Number

FAQ

What regulatory guidelines apply to Ethyl (4R)-5-(4-biphenylyl)-2-methyl-4-({[(2-methyl-2-propanyl)oxy]carbonyl}amino)-2-pentenoate (CAS: 149709-59-1)?

Are there alternatives to Ethyl (4R)-5-(4-biphenylyl)-2-methyl-4-({[(2-methyl-2-propanyl)oxy]carbonyl}amino)-2-pentenoate in synthesis?

What is the market or research trend for Ethyl (4R)-5-(4-biphenylyl)-2-methyl-4-({[(2-methyl-2-propanyl)oxy]carbonyl}amino)-2-pentenoate (CAS: 149709-59-1)?

How should waste containing Ethyl (4R)-5-(4-biphenylyl)-2-methyl-4-({[(2-methyl-2-propanyl)oxy]carbonyl}amino)-2-pentenoate (CAS: 149709-59-1) be handled?

Related Compounds

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