4-(3-Phosphonopropyl)-2-piperazinecarboxylic acid

Basic Information

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CAS Number

100828-16-8

Molecular Formula

C8H17N2O5P

Molecular Weight

252.21 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Agricultural Chemicals Pesticides Insecticides

Basic Physical Properties

Solubility

H2O: 99.2 mg/mL

SMILES

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C1CN(CC(N1)C(=O)O)CCCP(=O)(O)O

InChI

InChI=1S/C8H17N2O5P/c11-8(12)7-6-10(4-2-9-7)3-1-5-16(13,14)15/h7,9H,1-6H2,(H,11,12)(H2,13,14,15)

InChIKey

CUVGUPIVTLGRGI-UHFFFAOYSA-N

LogP

-1.0873999999999997

Topological Polar Surface Area

110.10000000000001 Å²

Hydrogen Bond Donor/Acceptor

4 / 7

Complexity

292

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

Synonyms & References

English

2-Piperazinecarboxylic acid, 4-(3-phosphonopropyl)-, (+-)-
4-(3-Phosphono-propyl)-piperazine-2-carboxylic acid
(+/-)-3-(2-CARBOXYPIPERAZIN-4-YL)-PROPYL-1-PHOSPHONICACID
NCGC00015179-03
(+/-)-3-(2-CARBOXYPIPERAZIN-4-YL)-PROPYL-1-PHOSPHONIC ACID
(+/-)-3-(2-Carboxypiperazin-4-yl)propyl-1-phosphonic acid
3-Phosphono-1-propyl-piperazine-2-carboxylic acid(DL-CPP)
9075-64-3
(RS)-3-(2-Carboxypiperazin-4-yl)-propyl-1-phosphonic acid
CUVGUPIVTLGRGI-UHFFFAOYSA-N
BDBM50002360
CS-0020444
(+/-)-CPP
98Y1I8ZD4M
[3H]CPP
NCGC00261007-01
(+)-3-(2-Carboxypiperazin-4-yl)-propyl-1-phosphoric Acid
SR-01000075428-1
100828-16-8
UNII-98Y1I8ZD4M
Q27272147
DTXSID10905774
DL-3-(2-Carboxypiperazin-4-yl)-propyl-1-phosphonic acid
(?)-CPP
J-510489
HMS3261A05
(CPP)4-(3-Phosphono-propyl)-piperazine-2-carboxylic acid
NCGC00024482-02
C8H17N2O5P
CHEMBL22304
3-(2-CARBOXYPIPERAZIN-4-YL)PROPYL-1-PHOSPHONATE

MDL Number

MFCD00055136

FAQ

What is 4-(3-Phosphonopropyl)-2-piperazinecarboxylic acid (CAS: 100828-16-8)?

4-(3-Phosphonopropyl)-2-piperazinecarboxylic acid (CAS: 100828-16-8) is a water-soluble organic compound with the molecular formula C8H16NO5P. It is characterized by its basic properties and has a pKa of approximately 8.6. This compound is used in various applications due to its unique chemical structure.

What are the main uses of 4-(3-Phosphonopropyl)-2-piperazinecarboxylic acid (CAS: 100828-16-8)?

4-(3-Phosphonopropyl)-2-piperazinecarboxylic acid (CAS: 100828-16-8) is primarily used in pharmaceuticals as a precursor for the synthesis of drugs. It is also utilized in the chemical industry for the production of other organic compounds and in research for its study of biological activity.

Is 4-(3-Phosphonopropyl)-2-piperazinecarboxylic acid (CAS: 100828-16-8) safe?

4-(3-Phosphonopropyl)-2-piperazinecarboxylic acid (CAS: 100828-16-8) is generally safe when handled properly. However, it should be kept away from open flames and strong oxidizers. Direct contact with skin and eyes should be avoided, and appropriate protective measures such as gloves and goggles should be used during handling.

How should 4-(3-Phosphonopropyl)-2-piperazinecarboxylic acid (CAS: 100828-16-8) be stored?

4-(3-Phosphonopropyl)-2-piperazinecarboxylic acid (CAS: 100828-16-8) should be stored in a cool, dry place, away from direct sunlight and heat sources. It is recommended to store it in a well-ventilated area and use a sealed container to prevent moisture absorption. The storage temperature should not exceed 25°C to ensure stability and safety.