(2S,4E)-2-{[(9H-Fluoren-9-ylmethoxy)carbonyl]amino}-5-phenyl-4-pentenoic acid

Basic Information

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CAS Number

159610-82-9

Molecular Formula

C26H23NO4

Molecular Weight

413.47 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Ethers

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Basic Physical Properties

Melting Point

141.7 °C

Boiling Point

532.63°C (rough estimate)

Solubility

Insuluble (3.9E-4 g/L) (25 ºC),

Refractive Index

1.6000 (estimate)

SMILES

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C1=CC=C(C=C1)C=CCC(C(=O)O)NC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24

InChI

InChI=1S/C26H23NO4/c28-25(29)24(16-8-11-18-9-2-1-3-10-18)27-26(30)31-17-23-21-14-6-4-12-19(21)20-13-5-7-15-22(20)23/h1-15,23-24H,16-17H2,(H,27,30)(H,28,29)/b11-8+/t24-/m0/s1

InChIKey

ZFMHHKMOLFNMMV-DDVUFSRBSA-N

LogP

5.081800000000004

Topological Polar Surface Area

75.63000000000001 Å²

Hydrogen Bond Donor/Acceptor

2 / 5

Complexity

619

Synonyms & References

English

Fmoc-Ala(Styr)-OH
159610-82-9
J-501830
Fmoc-L-Styrylalanine
(S,E)-2-((((9H-fluoren-9-yl)methoxy)carbonyl)amino)-5-phenylpent-4-enoic acid
(E,2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-5-phenylpent-4-enoic acid
CS-0149834
4-Pentenoic acid, 2-[[(9H-fluoren-9-ylmethoxy)carbonyl]amino]-5-phenyl-, [S-(E)]- (9CI)
(S)-2-((((9H-Fluoren-9-yl)methoxy)carbonyl)amino)-5-phenylpent-4-enoic acid
Fmoc-L-Styrylalanine (Fmoc-L-Ala(Styryl)-OH )
Fmoc-3-styryl-L-alanine
PS-12154
W18815
(S,E)-2-((((9H-fluoren-9-yl)methoxy)carbonyl)amino)-5-phenylpent-4-enoicacid
Fmoc-beta-styryl-Ala-OH, >=98.0% (HPLC)
A815445
(E)-2-((((9H-fluoren-9-yl)methoxy)carbonyl)amino)-5-phenylpent-4-enoic acid
(E, 2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-5-phenylpent-4-enoic acid
Fmoc-beta-styryl-Ala-OH
SCHEMBL120671
(s)-2-(fmoc-amino)-5-phenyl-4-pentenoic acid
(2S,4E)-2-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)-5-phenylpent-4-enoic acid
215190-24-2
AC-9973
4-Pentenoicacid,2-[[(9H-fluoren-9-ylmethoxy)carbonyl]amino]-5-phenyl-,[s-(E)]-(9ci)
MFCD01311748
AKOS016843708
4-Pentenoicacid, 2-[[(9H-fluoren-9-ylmethoxy)carbonyl]amino]-5-phenyl-, [S-(E)]- (9CI)
(S)-2-(9-Fluorenylmethoxycarbonylamino)-5-phenyl-4-(E)-penten-1-oic-acid
(S)-N-FMOC-STYRYLALANINE
(S)-N-fmoc-Styrylalanine(e.e.)

MDL Number

MFCD01311748

FAQ

What are the physical and chemical properties of (2S,4E)-2-{[(9H-Fluoren-9-ylmethoxy)carbonyl]amino}-5-phenyl-4-pentenoic acid (CAS: 159610-82-9)?

The compound (2S,4E)-2-{[(9H-Fluoren-9-ylmethoxy)carbonyl]amino}-5-phenyl-4-pentenoic acid (CAS: 159610-82-9) is a crystalline solid with a molecular weight of approximately 515.4 g/mol. It exhibits low solubility in water but good solubility in organic solvents like chloroform and acetone. The compound is reactive towards nucleophiles and can undergo esterification and amide formation reactions. It is stable under normal conditions but decomposes under strong basic or acidic conditions.

How is (2S,4E)-2-{[(9H-Fluoren-9-ylmethoxy)carbonyl]amino}-5-phenyl-4-pentenoic acid (CAS: 159610-82-9) typically synthesized?

(2S,4E)-2-{[(9H-Fluoren-9-ylmethoxy)carbonyl]amino}-5-phenyl-4-pentenoic acid (CAS: 159610-82-9) can be synthesized via a multistep process involving the protection of a carboxylic acid, amide formation, and deprotection. Commonly, a protected intermediate is first synthesized, followed by amination with a protected amino reagent. The product is then isolated and purified using column chromatography. The synthesis typically employs mild conditions and mild solvents to ensure high yield and selectivity.

What industries use (2S,4E)-2-{[(9H-Fluoren-9-ylmethoxy)carbonyl]amino}-5-phenyl-4-pentenoic acid (CAS: 159610-82-9)?

(2S,4E)-2-{[(9H-Fluoren-9-ylmethoxy)carbonyl]amino}-5-phenyl-4-pentenoic acid (CAS: 159610-82-9) is primarily used in the pharmaceutical industry for drug development. It also finds applications in the synthesis of functional polymers and as a building block in the preparation of various chemical sensors. Additionally, it is used in the semiconductor industry for its electronic properties.

What precautions should be taken when handling (2S,4E)-2-{[(9H-Fluoren-9-ylmethoxy)carbonyl]amino}-5-phenyl-4-pentenoic acid (CAS: 159610-82-9)?

When handling (2S,4E)-2-{[(9H-Fluoren-9-ylmethoxy)carbonyl]amino}-5-phenyl-4-pentenoic acid (CAS: 159610-82-9), it is essential to wear appropriate personal protective equipment (PPE) such as gloves, lab coat, and safety goggles. The compound should be handled in a well-ventilated area or a fume hood to avoid inhalation. In case of a spill, use appropriate absorbent materials like calcium carbonate or sodium bicarbonate. The Material Safety Data Sheet (MSDS) should be consulted for detailed emergency procedures and safety information.