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

Basic Information

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CAS Number

70796-17-7

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

Melting Point

110-122°C

Specific Rotation

+17.10° (c = 2% in 1 M HCl)

SMILES

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C(C[C@@H](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

L-Citrulline DL-malate (1:1)
L-Citrulline-Dl-Malate
Citrulline malate
L-Citrulline dl-malate
l-Citrulline dl-malate(1:1)
(2S)-2-amino-5-(carbamoylamino)pentanoic acid; 2-hydroxybutanedioic acid
Stimol
Citrulline malate [WHO-DD]
Stimol (TN)
L-CitrullineDL-Malate2:1
PAB4036KHO
L-Citrulline DL-malate (1
L-Citrulline DL-Malate 2:1
L-Ornithine, N5-(aminocarbonyl)-, hydroxybutanedioate (1:1)
C10H19N3O8
L-O
L-Citrulline DL-malate

MDL Number

MFCD09839004

FAQ

What are the physical and chemical properties of N~5~-Carbamoyl-L-ornithine - 2-hydroxysuccinic acid (1:1) (CAS: 70796-17-7)?

N~5~-Carbamoyl-L-ornithine - 2-hydroxysuccinic acid (1:1) is a crystalline solid with a molecular weight of approximately 413.37 g/mol. It is slightly soluble in water. The compound is reactive under acidic conditions and stable under neutral and basic conditions. It is an important intermediate in the synthesis of various bioactive compounds.

How is N~5~-Carbamoyl-L-ornithine - 2-hydroxysuccinic acid (1:1) (CAS: 70796-17-7) typically synthesized?

N~5~-Carbamoyl-L-ornithine - 2-hydroxysuccinic acid (1:1) is typically synthesized via a multi-step process involving the carbamoylation of L-ornithine followed by condensation with 2-hydroxysuccinic acid. The reaction is catalyzed by a Lewis acid such as aluminum chloride, and the yield is around 70-80% depending on the purity of starting materials.

What industries use N~5~-Carbamoyl-L-ornithine - 2-hydroxysuccinic acid (1:1) (CAS: 70796-17-7)?

N~5~-Carbamoyl-L-ornithine - 2-hydroxysuccinic acid (1:1) is used in pharmaceuticals for the synthesis of certain bioactive compounds. It also finds applications in the production of polymers and as a precursor in the development of sensors and semiconductors.

What precautions should be taken when handling N~5~-Carbamoyl-L-ornithine - 2-hydroxysuccinic acid (1:1) (CAS: 70796-17-7)?

When handling N~5~-Carbamoyl-L-ornithine - 2-hydroxysuccinic acid (1:1), use gloves, goggles, and a lab coat. Store the compound in a cool, dry place away from direct sunlight. In case of spillage, neutralize the acid with a base and dispose of according to local regulations. Always refer to the Safety Data Sheet (SDS) for complete information on handling and storage.