2-Methyl-2-propanyl 3-oxo-1-piperazinecarboxylate

Basic Information

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CAS Number

76003-29-7

Molecular Formula

C9H16N2O3

Molecular Weight

200.24 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

Basic Physical Properties

Physical State

White to Yellow Solid

Melting Point

158.0 to 164.0 deg-C

Flash Point

171℃

SMILES

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CC(C)(C)OC(=O)N1CCNC(=O)C1

InChI

InChI=1S/C9H16N2O3/c1-9(2,3)14-8(13)11-5-4-10-7(12)6-11/h4-6H2,1-3H3,(H,10,12)

InChIKey

FCMLWBBLOASUSO-UHFFFAOYSA-N

LogP

0.3533

Topological Polar Surface Area

58.64 Å²

Hydrogen Bond Donor/Acceptor

1 / 5

Complexity

245

Safety Information

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GHS Hazard Pictograms

H315

H319

H335

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

B3804
PB29196
4-tert-butoxycarbonylpiperazin-2-one
piperazin-3-one-1-carboxylic acid tert-butyl ester
AM20100743
PS-5186
76003-29-7
HY-W001639
1-Boc-3-oxopiperazine
A9645
4-tert-butoxycarbonyl-2-piperazinone
4-tert-butyloxycarbonyl-piperazin-2-one
3-Oxo-piperazine-1-carboxylic acidtert-butylester
IFLab1_005757
Boc-3-oxopiperazine
1-t-Butoxycarbonyl-3-oxopiperazine
1-t-butyloxycarbonyl-3-oxopiperazine
4-N-Boc-2-oxo-piperazine
1-Boc-3-oxopiperazine, 98%
1-tert-butoxycarbonyl-3-oxopiperazine
4-(tert-Butyloxycarbonyl)-2-oxopiperazine
4-tert butoxycarbonylpiperazin-2-one
1-Boc-3-oxopiperazine, puriss., 98%
AKOS000302339
AC-6696
CS-W001639
1-Boc-oxopiperzine
MFCD02181069
SY005965
AN-329/42173581
4-(tert-butoxycarbonyl)-2-piperazinone

MDL Number

MFCD02181069

Customs Code

2933599090

FAQ

What are the physical and chemical properties of 2-Methyl-2-propanyl 3-oxo-1-piperazinecarboxylate (CAS: 76003-29-7)?

2-Methyl-2-propanyl 3-oxo-1-piperazinecarboxylate is a crystalline solid with a molecular weight of approximately 236.38 g/mol. It has a solubility of about 0.1 g/100 mL in water and is slightly soluble in common organic solvents. The compound is moderately reactive, especially under acidic conditions, making it suitable for use in various chemical transformations. It is stable under normal storage conditions but should be protected from moisture and heat.