(2S)-2-{[(9H-Fluoren-9-ylmethoxy)carbonyl]amino}-4-[(2-methyl-2-propanyl)oxy]-4-oxobutanoic acid

Basic Information

View in Editor

CAS Number

71989-14-5

Molecular Formula

C23H25NO6

Molecular Weight

411.45 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

Melting Point

148.0 to 152.0 deg-C

Boiling Point

620.8°C at 760 mmHg

Density

1.2498 (rough estimate)

Water Solubility

Slightly soluble in water.

Flash Point

329.3℃

Refractive Index

-25 ° (C=1, DMF)

Specific Rotation

-25 º (c=1,DMF 24 ºC)

SMILES

View in Editor

CC(C)(C)OC(=O)CC(C(=O)O)NC(=O)OCC1C2=CC=CC=C2C3=CC=CC=C13

InChI

InChI=1S/C23H25NO6/c1-23(2,3)30-20(25)12-19(21(26)27)24-22(28)29-13-18-16-10-6-4-8-14(16)15-9-5-7-11-17(15)18/h4-11,18-19H,12-13H2,1-3H3,(H,24,28)(H,26,27)/t19-/m0/s1

InChIKey

FODJWPHPWBKDON-IBGZPJMESA-N

LogP

3.7101000000000024

Topological Polar Surface Area

101.92999999999999 Å²

Hydrogen Bond Donor/Acceptor

2 / 7

Complexity

620

Safety Information

View Safety Information

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

Hazard Class

Class IRRITANT Class IRRITANT

Synonyms & References

English

Fmoc-L-aspartic acid b-tert-butyl ester
Fmoc-L-aspartic acid 4-tert-butyl ester
4-tert-Butyl N-(fluoren-9-ylmethoxycarbonyl)-L-aspartate
J-300058
Fmoc-L-Asp(tBu)
DTXSID001315581
N-[(9H-Fluoren-9-ylmethoxy)carbonyl]-L-aspartic Acid 4-tert-Butyl Ester
N-Alpha-Fmoc-L-aspartic acid beta-t-butyl ester
(S)-2-((((9H-Fluoren-9-yl)methoxy)carbonyl)amino)-4-(tert-butoxy)-4-oxobutanoic acid
A837378
AS-14174
MFCD00037131
Fmoc-Asp(OtBu)-OH
Fmoc-L-Aspartic acid beta-tert-butyl ester
BP-23513
(s)-2-(((9h-fluoren-9-yl)methoxy)carbonylamino)-4-tert-butoxy-4-oxobutanoic acid
71989-14-5
SCHEMBL872021
Fmoc-L-Asp(OtBu)-OH
JHQ6MY724T
4-tert-Butyl N-Fmoc-L-aspartate
FmocAsp(OBut)OH
FODJWPHPWBKDON-IBGZPJMESA-N
EN300-96401
N-9-Fluorenylmethyloxycarbonyl-L-aspartic acid beta-t-butyl ester
Fmoc-Asp(tBu)-OH
Fmoc-Asp(t-Bu)-OH
Fmoc-L-aspartic acid beta-tert.buty ester
HY-Y1169
BCP08108
CS-D1469

MDL Number

MFCD00037131

Customs Code

2924299090

FAQ

What is (2S)-2-{[(9H-Fluoren-9-ylmethoxy)carbonyl]amino}-4-[(2-methyl-2-propanyl)oxy]-4-oxobutanoic acid (CAS: 71989-14-5)?

This compound is a complex organic molecule with the chemical formula C26H33NO5. It contains a fluorene ring, a butanoic acid group, and multiple functional groups such as amino and hydroxy functionalities. Its structure suggests potential use in pharmaceutical or synthetic chemistry applications due to the presence of functional groups that can participate in various chemical reactions.

What are the main uses of (2S)-2-{[(9H-Fluoren-9-ylmethoxy)carbonyl]amino}-4-[(2-methyl-2-propanyl)oxy]-4-oxobutanoic acid (CAS: 71989-14-5)?

This compound is primarily used in pharmaceutical research as a building block for drug development. It may also find applications in organic synthesis and materials science due to its structural complexity and functional group versatility. Its specific uses are still being explored due to its novelty in chemical structure.

Is (2S)-2-{[(9H-Fluoren-9-ylmethoxy)carbonyl]amino}-4-[(2-methyl-2-propanyl)oxy]-4-oxobutanoic acid (CAS: 71989-14-5) safe?

Safety data for this compound is limited, but as a chemical used in research, it should be handled with appropriate care. It is advisable to use protective equipment such as gloves and goggles when working with it, and to follow standard laboratory safety protocols. Always consult safety data sheets (SDS) for detailed information on toxicity and handling.

How should (2S)-2-{[(9H-Fluoren-9-ylmethoxy)carbonyl]amino}-4-[(2-methyl-2-propanyl)oxy]-4-oxobutanoic acid (CAS: 71989-14-5) be stored?

This compound should be stored in a cool, dry, and dark place, ideally at 2-8°C. It should be kept in a sealed container to prevent moisture absorption and contamination. Avoid exposure to air and light to maintain stability and prolong shelf life. Storage conditions may vary based on specific formulation or manufacturer guidelines.