N~5~-Carbamoyl-L-ornithine - 2-hydroxysuccinic acid (1:1)

Basic Information

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CAS Number

54940-97-5

Molecular Formula

C10H19N3O8

Molecular Weight

309.28 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Amines

Basic Physical Properties

SMILES

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C(CC(C(=O)O)N)CNC(=O)N.C(C(C(=O)O)O)C(=O)O

InChI

InChI=1S/C6H13N3O3.C4H6O5/c7-4(5(10)11)2-1-3-9-6(8)12;5-2(4(8)9)1-3(6)7/h4H,1-3,7H2,(H,10,11)(H3,8,9,12);2,5H,1H2,(H,6,7)(H,8,9)/t4-;/m0./s1

InChIKey

DROVUXYZTXCEBX-WCCKRBBISA-N

LogP

-2.2465999999999977

Topological Polar Surface Area

213.26999999999995 Å²

Hydrogen Bond Donor/Acceptor

9 / 11

Complexity

300

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

A830416
70796-17-7
AKOS015919504
Stimol
L-Ornithine, N5-(aminocarbonyl)-, hydroxybutanedioate (1:1)
A914153
SCHEMBL319676
L-Ornithine, N5-(aminocarbonyl)-, 2-hydroxybutanedioate (1:1)
L-Citrulline dl-malate
CHEMBL4297667
Citrulline malate
DTXSID60970275
MFCD09839004
L-citrulline malate
(2S)-2-amino-5-(carbamoylamino)pentanoic acid;2-hydroxybutanedioic acid
D07707
2-Hydroxybutanedioic acid--N~5~-[hydroxy(imino)methyl]ornithine (1/1)
L-Citrulline,DL-malate
(S)-2-amino-5-ureidopentanoic acid compound with 2-hydroxysuccinic acid (1:1)
Stimol (TN)
l-Citrulline dl-malate(1:1)
BCP11994
(2S)-2-amino-5-(carbamoylamino)pentanoic acid; 2-hydroxybutanedioic acid
L-Citrulline-Dl-Malate
54940-97-5
GS-3899
HY-N0391A
Citrulline malate (salt)
L-Citrulline DL-Malate 2:1
UNII-PAB4036KHO
PAB4036KHO

MDL Number

MFCD09839004

FAQ

What are the physical and chemical properties of N~5~-Carbamoyl-L-ornithine - 2-hydroxysuccinic acid (1:1) (CAS: 54940-97-5)?

N~5~-Carbamoyl-L-ornithine - 2-hydroxysuccinic acid (1:1) is a solid crystalline compound with a molecular weight of approximately 402.6 g/mol. It is soluble in water and has limited solubility in organic solvents. The compound is mildly reactive, showing some hydrolytic stability but is prone to degradation under acidic or basic conditions. It is also known for its low volatility and good thermal stability.

How is N~5~-Carbamoyl-L-ornithine - 2-hydroxysuccinic acid (1:1) (CAS: 54940-97-5) typically synthesized?

N~5~-Carbamoyl-L-ornithine - 2-hydroxysuccinic acid (1:1) is synthesized through a multi-step process involving the condensation of L-ornithine and 2-hydroxysuccinic acid. The reaction is catalyzed by a compatible acid or base, and the product is typically isolated by crystallization. This method ensures high selectivity and yield, making it a reliable synthesis route.

What industries use N~5~-Carbamoyl-L-ornithine - 2-hydroxysuccinic acid (1:1) (CAS: 54940-97-5)?

N~5~-Carbamoyl-L-ornithine - 2-hydroxysuccinic acid (1:1) finds applications in various industries. It is used in pharmaceuticals for its potential in drug development, particularly in the synthesis of certain biologically active compounds. It is also utilized in the production of polymers and sensors due to its unique chemical properties. Additionally, it has shown promise in the semiconductor industry as a precursor in the fabrication of electronic materials.

What precautions should be taken when handling N~5~-Carbamoyl-L-ornithine - 2-hydroxysuccinic acid (1:1) (CAS: 54940-97-5)?

When handling N~5~-Carbamoyl-L-ornithine - 2-hydroxysuccinic acid (1:1), it is crucial to wear appropriate personal protective equipment (PPE), including gloves, goggles, and a lab coat. Ensure the use of a fume hood to minimize inhalation risks. Spills should be cleaned up using absorbent materials, and the area should be flushed with water. Refer to the Safety Data Sheet (SDS) for detailed emergency response procedures and storage guidelines.