ChemicalBook--->CAS DataBase List--->13594-51-9

13594-51-9

13594-51-9 Structure

13594-51-9 Structure
IdentificationMore
[Name]

H-D-CIT-OH
[CAS]

13594-51-9
[Synonyms]

D-CITRULLINE
H-D-CIT-OH
H-D-CITRULLINE
H-D-ORN(CARBAMOYL)-OH
H-D-ORN(CONH2)-OH
N-DELTA-CARBAMOYL-D-ORNITHINE
(R)-2-AMINO-5-UREIDOPENTANOIC ACID
D-citrulline dihydrate
D-CITRULLIN
D-Citrulline, (R)-2-Amino-5-ureidopentanoic acid
D-ORNITHINE, N5-(AMINOCARBONYL)-
[EINECS(EC#)]

211-012-2
[Molecular Formula]

C6H13N3O3
[MDL Number]

MFCD00216469
[Molecular Weight]

175.19
[MOL File]

13594-51-9.mol
Chemical PropertiesBack Directory
[Appearance]

White powder
[Melting point ]

220-221°C
[Boiling point ]

386.7±42.0 °C(Predicted)
[density ]

1.289±0.06 g/cm3(Predicted)
[storage temp. ]

−20°C
[form ]

powder
[pka]

2.51±0.24(Predicted)
[Optical Rotation]

[α]20/D 20.5±2.0°, c = 2% in 1 M HCl
[Detection Methods]

Rotation
[BRN ]

1725415
[Major Application]

peptide synthesis
[InChI]

InChI=1S/C6H13N3O3/c7-4(5(10)11)2-1-3-9-6(8)12/h4H,1-3,7H2,(H,10,11)(H3,8,9,12)/t4-/m1/s1
[InChIKey]

RHGKLRLOHDJJDR-SCSAIBSYSA-N
[SMILES]

C(O)(=O)[C@@H](CCCNC(N)=O)N
[CAS DataBase Reference]

13594-51-9(CAS DataBase Reference)
Safety DataBack Directory
[WGK Germany ]

3
[Storage Class]

11 - Combustible Solids
Hazard InformationBack Directory
[Chemical Properties]

White powder
[Application]

Cetrorelix (antineoplastic)
[Definition]

ChEBI: D-citrulline is a citrulline. It is an enantiomer of a L-citrulline.
[reaction suitability]

reaction type: solution phase peptide synthesis
Well-known Reagent Company Product InformationBack Directory
[Sigma Aldrich]

13594-51-9(sigmaaldrich)
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