Benzyl 3-oxo-1-piperazinecarboxylate

Basic Information

View in Editor

CAS Number

78818-15-2

Molecular Formula

C12H14N2O3

Molecular Weight

234.25 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Basic Physical Properties

Physical State

Powder

Melting Point

117.0 to 121.0 deg-C

SMILES

View in Editor

C1CN(CC(=O)N1)C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C12H14N2O3/c15-11-8-14(7-6-13-11)12(16)17-9-10-4-2-1-3-5-10/h1-5H,6-9H2,(H,13,15)

InChIKey

BAHFPJFBMJTOPU-UHFFFAOYSA-N

LogP

0.7549999999999999

Topological Polar Surface Area

58.64 Å²

Hydrogen Bond Donor/Acceptor

1 / 5

Complexity

288

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

4-benzyloxycarbonyl-piperazin-2-one
BRD-K49349109-001-01-7
J-519795
4-Benzyloxycarbonyl-2-oxopiperazine
3-Oxopiperazine-1-carboxylic acid benzyl ester, 4-Benzyloxycarbonyl-2-piperazinone
3-Oxopiperazine-1-carboxylic acid benzyl ester
Z31603335
benzyl 3-oxotetrahydro-1(2h)-pyrazinecarboxylate
DTXSID60353100
1-Z-3-oxopiperazine
1-(2-Phenylaziridin-1-yl)propan-2-ol
CS-W002474
SY018232
4-benyloxycarbonylpiperazin-2-one
CCG-49850
4-benzyloxycarbonyl-2-oxo-piperazine
Maybridge1_008979
FT-0622800
1-Carbobenzoxy-3-oxopiperazine
AKOS005069579
1-carbobenzoxypiperazin-3-one
3-oxo-piprazine-1-carboxylic acid benzyl ester
1-Z-3-oxopiperazine, 97%
1-Cbz-3-oxopiperazine
78818-15-2
4-Benzyloxycarbonylpiperazin-2-one
4-(Benzyloxycarbonyl)-piperazin-2-one
benzyl 3-oxopiperazine-1-carboxylate
AM20041176
4-(Benzyloxycarbonyl)-2-piperazinone
A839503

MDL Number

MFCD00173924

Customs Code

2933599090

FAQ

What regulatory guidelines apply to Benzyl 3-oxo-1-piperazinecarboxylate (CAS: 78818-15-2)?

Benzyl 3-oxo-1-piperazinecarboxylate (CAS: 78818-15-2) is subject to various regulatory guidelines including GHS classification, which categorizes it based on its physical, health, and environmental hazards. In the EU, it is also regulated under REACH, requiring manufacturers and importers to register substances with concentrations above 1 tonne per year. Additionally, FDA and EPA have specific requirements for its use and disposal in the United States, focusing on safety and environmental impact.

Are there alternatives to Benzyl 3-oxo-1-piperazinecarboxylate (CAS: 78818-15-2) in synthesis?

In the synthesis of benzyl 3-oxo-1-piperazinecarboxylate (CAS: 78818-15-2), researchers often explore alternative reagents such as benzyl 3-hydroxypiperazine-1-carboxylate or similar derivatives. These alternatives can vary depending on the specific reaction conditions and the desired product. Isomers and analogs, such as 3-oxo-1-(cyclohexylmethyl)piperazine-1-carboxylate, are also considered as potential substitutes.

What is the market or research trend for Benzyl 3-oxo-1-piperazinecarboxylate (CAS: 78818-15-2)?

The market for benzyl 3-oxo-1-piperazinecarboxylate (CAS: 78818-15-2) is currently growing due to its applications in pharmaceuticals and agrochemicals. Research trends are focusing on its potential as a scaffold for developing new drugs. Market dynamics are influenced by increasing demand from the pharmaceutical industry, with price fluctuations driven by supply and demand. Emerging research fields include its use in anti-inflammatory and analgesic drug discovery.

How should waste containing Benzyl 3-oxo-1-piperazinecarboxylate (CAS: 78818-15-2) be handled?

Waste containing benzyl 3-oxo-1-piperazinecarboxylate (CAS: 78818-15-2) should be collected in a sealed container and stored in a secure location away from ignition sources. Proper incineration or professional waste disposal services should be used to handle the waste. Environmental protection precautions include minimizing water contamination and ensuring that waste is disposed of in accordance with local, national, and international regulations. Safe handling and disposal are critical to preventing environmental and health hazards.