O-Benzyl-N-{[(2-methyl-2-propanyl)oxy]carbonyl}-D-serine

Basic Information

View in Editor

CAS Number

47173-80-8

Molecular Formula

C15H21NO5

Molecular Weight

295.34 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

Physical State

Powder

Melting Point

58.0 to 62.0 deg-C

Boiling Point

456.2°C at 760 mmHg

Flash Point

229.7°C

Refractive Index

-20 ° (C=2, 80% EtOH)

Specific Rotation

-19 º (c=2 80% alcohol)

SMILES

View in Editor

CC(C)(C)OC(=O)NC(COCC1=CC=CC=C1)C(=O)O

InChI

InChI=1S/C15H21NO5/c1-15(2,3)21-14(19)16-12(13(17)18)10-20-9-11-7-5-4-6-8-11/h4-8,12H,9-10H2,1-3H3,(H,16,19)(H,17,18)/t12-/m1/s1

InChIKey

DMBKPDOAQVGTST-GFCCVEGCSA-N

LogP

2.1811

Topological Polar Surface Area

84.86 Å²

Hydrogen Bond Donor/Acceptor

2 / 6

Complexity

345

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

AS-19914
Boc-(R)-2-amino-3-benzyloxypropionic acid
Nalpha-t-butoxycarbonyl-O-benzyl-D-serine
HY-W004064
Boc-D-Ser(OBn)-OH
Boc-D-Ser(Bzl)-OH
Boc-O-benzyl-D-serine
N-tert-butyloxycarbonyl-O-benzyl-D-serine
B1863
CS-W004064
Boc-D-Ser(Bzl)-OH, >=98.0% (HPLC)
J-300235
M06201
N-a-t.-Boc-O-benzyl-D-serine
47173-80-8
N-Boc-O-benzyl-D-serine
(R)-3-(benzyloxy)-2-(tert-butoxycarbonylamino)propanoic acid
(2R)-3-(benzyloxy)-2-{[(tert-butoxy)carbonyl]amino}propanoic acid
SCHEMBL1132901
MFCD00038248
Q-101719
DMBKPDOAQVGTST-GFCCVEGCSA-N
(R)-3-(benzyloxy)-2-((tert-butoxycarbonyl)amino)propanoic acid
N-(t-Butoxycarbonyl)-O-benzyl-D-serine
EN300-1699035
Boc-O-Benzyl-D-Serine;T-Butyloxycarbonyl-o-benzyl-d-serine; N-Alpha-t-boc-o-benzyl-l-serine
t-butyloxycarbonyl-O-benzyl-D-serine
AKOS016843554
N-(tert-Butyloxycarbonyl)-O-Benzyl-D-Serine
O-Benzyl-N-(tert-butoxycarbonyl)-D-serine
(2R)-3-benzyloxy-2-(N-(t-butoxycarbonyl)amino)propanoic acid

MDL Number

MFCD00038248

Customs Code

2924299090

FAQ

What are the physical and chemical properties of O-Benzyl-N-{[(2-methyl-2-propanyl)oxy]carbonyl}-D-serine (CAS: 47173-80-8)?

O-Benzyl-N-{[(2-methyl-2-propanyl)oxy]carbonyl}-D-serine is a solid at room temperature with a crystalline form. Its molecular weight is approximately 340.42 g/mol. It is slightly soluble in water and organic solvents. Chemically, it is relatively stable but can undergo hydrolysis under basic conditions. This compound shows moderate reactivity with nucleophiles and is commonly used in chemical synthesis.

How is O-Benzyl-N-{[(2-methyl-2-propanyl)oxy]carbonyl}-D-serine (CAS: 47173-80-8) typically synthesized?

O-Benzyl-N-{[(2-methyl-2-propanyl)oxy]carbonyl}-D-serine can be synthesized through a multi-step process. It typically involves the activation of D-serine followed by coupling with benzyl chloroformate in the presence of a base. The reaction is usually carried out in an organic solvent, and the yield is generally around 85%. Catalysts and solvents can vary depending on the specific conditions chosen.

What industries use O-Benzyl-N-{[(2-methyl-2-propanyl)oxy]carbonyl}-D-serine (CAS: 47173-80-8)?

O-Benzyl-N-{[(2-methyl-2-propanyl)oxy]carbonyl}-D-serine is primarily used in the pharmaceutical industry for the synthesis of various drugs. It also finds applications in the polymer industry as a monomer and in the development of sensors for detecting specific chemical compounds. Additionally, it is used in the production of semiconductors as a precursor for certain materials.

What precautions should be taken when handling O-Benzyl-N-{[(2-methyl-2-propanyl)oxy]carbonyl}-D-serine (CAS: 47173-80-8)?

When handling O-Benzyl-N-{[(2-methyl-2-propanyl)oxy]carbonyl}-D-serine, it is important to use personal protective equipment (PPE) such as gloves and goggles. The compound should be stored in a well-ventilated area, and exposure to air should be minimized. Fume hoods should be used during handling. In case of a spill, the area should be cleaned up immediately and the SDS (Safety Data Sheet) should be consulted for proper disposal and decontamination procedures.