(S)-3-((((9H-Fluoren-9-yl)methoxy)carbonyl)amino)-4-(allyloxy)-4-oxobutanoic acid

Basic Information

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CAS Number

144120-53-6

Molecular Formula

C22H21NO6

Molecular Weight

395.41 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

131.0 to 135.0 deg-C

Boiling Point

634.8°C at 760 mmHg

Density

1.2860

Flash Point

340°C

Refractive Index

1.591

SMILES

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

InChI

InChI=1S/C22H21NO6/c1-2-11-28-21(26)19(12-20(24)25)23-22(27)29-13-18-16-9-5-3-7-14(16)15-8-4-6-10-17(15)18/h2-10,18-19H,1,11-13H2,(H,23,27)(H,24,25)/t19-/m0/s1

InChIKey

ZJMVIWUCCRKNHY-IBGZPJMESA-N

LogP

3.0976000000000017

Topological Polar Surface Area

101.93000000000002 Å²

Hydrogen Bond Donor/Acceptor

2 / 7

Complexity

598

Safety Information

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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

SCHEMBL118904
CS-W017785
I10340
(S)-3-(((9H-fluoren-9-yl)methoxy)carbonylamino)-4-(allyloxy)-4-oxobutanoic acid
PD196992
HY-W017069
N-Fmoc-L-aspartic Acid 1-Allyl Ester
AKOS016008679
(3S)-3-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)-4-oxo-4-(prop-2-en-1-yloxy)butanoic acid
L-Aspartic acid, N-[(9H-fluoren-9-ylmethoxy)carbonyl]-, 1-(2-propen-1-yl) ester
n-alpha-fmoc-l-aspartic acid alpha-allyl ester
Fmoc-L-aspartic acid a-allyl ester
1-Allyl N-[(9H-Fluoren-9-ylmethoxy)carbonyl]-L-aspartate
J-007920
(3S)-3-(9H-fluoren-9-ylmethoxycarbonylamino)-4-oxo-4-prop-2-enoxybutanoic acid
AS-12080
AM81609
N-[(9H-Fluoren-9-ylmethyloxycarbonyl)]-L-aspartic Acid 1-Allyl Ester
(S)-3-((((9H-Fluoren-9-yl)methoxy)carbonyl)amino)-4-(allyloxy)-4-oxobutanoic acid
EN300-6747973
(3S)-4-allyloxy-3-(9H-fluoren-9-ylmethoxycarbonylamino)-4-oxo-butanoic acid
Fmoc-L-aspartic acid 1-allyl ester
Fmoc-Asp-OAl
ZJMVIWUCCRKNHY-IBGZPJMESA-N
MFCD00467715
FmocAsp(OH)Oallyl
Fmoc-Asp(OH)-Oallyl
1-Allyl N-Fmoc-L-aspartate
M03408
Fmoc-Asp-OAll
AC-1154

MDL Number

MFCD00467715

Customs Code

2924299090

FAQ

What is (S)-3-((((9H-Fluoren-9-yl)methoxy)carbonyl)amino)-4-(allyloxy)-4-oxobutanoic acid (CAS: 144120-53-6)?

(S)-3-((((9H-Fluoren-9-yl)methoxy)carbonyl)amino)-4-(allyloxy)-4-oxobutanoic acid is a chiral compound with a complex molecular structure. It is characterized by its unique combination of a fluorene-based moiety and an allyl ester group. This compound is often used in pharmaceuticals and research applications due to its specific biochemical properties.

What are the main uses of (S)-3-((((9H-Fluoren-9-yl)methoxy)carbonyl)amino)-4-(allyloxy)-4-oxobutanoic acid (CAS: 144120-53-6)?

(S)-3-((((9H-Fluoren-9-yl)methoxy)carbonyl)amino)-4-(allyloxy)-4-oxobutanoic acid is primarily used in pharmaceutical research for its potential in drug development. It is also utilized in the synthesis of other organic compounds and in academic research for studying specific biochemical pathways.

Is (S)-3-((((9H-Fluoren-9-yl)methoxy)carbonyl)amino)-4-(allyloxy)-4-oxobutanoic acid (CAS: 144120-53-6) safe?

(S)-3-((((9H-Fluoren-9-yl)methoxy)carbonyl)amino)-4-(allyloxy)-4-oxobutanoic acid is considered safe under proper handling and storage conditions. However, it is important to follow all safety precautions, including wearing appropriate personal protective equipment and storing it in a cool, dry place away from direct sunlight and sources of ignition.

How should (S)-3-((((9H-Fluoren-9-yl)methoxy)carbonyl)amino)-4-(allyloxy)-4-oxobutanoic acid (CAS: 144120-53-6) be stored?

(S)-3-((((9H-Fluoren-9-yl)methoxy)carbonyl)amino)-4-(allyloxy)-4-oxobutanoic acid should be stored in a cool, dry place with a temperature range of 15-25°C (59-77°F) and a relative humidity below 60%. It should be kept away from direct sunlight and heat sources. The container should be tightly sealed to prevent moisture and contaminants from entering. Additionally, it should be stored separately from incompatible substances.