Cbz-L-Arginine hydrochloride - ≥98% , CAS No.56672-63-0

CAS: 56672-63-0 Cat. No.: A107819 Molecular Weight: 344.79 Beilstein Registry Number: 4622382 EC Number: 611-409-4 PubChem CID: 13104814

GRADE & PURITY ≥98%

Synonyms

N~2~-[(Benzyloxy)carbonyl]-L-arginine hydrochloride | NCGC00166307-06 | SCHEMBL333889 | AKOS015902006 | Z-Arg.HCl | (S)-2-(benzyloxycarbonylamino)-5-guanidinopentanoic acid hydrochloride | MFCD00038946 | AS-70968 | benzyloxy-carbonyl arginine hydrochlorid

Storage

Argon charged,Room temperature

Shipped In

Normal

Specifications

Synonyms

N~2~-[(Benzyloxy)carbonyl]-L-arginine hydrochloride | NCGC00166307-06 | SCHEMBL333889 | AKOS015902006 | Z-Arg.HCl | (S)-2-(benzyloxycarbonylamino)-5-guanidinopentanoic acid hydrochloride | MFCD00038946 | AS-70968 | benzyloxy-carbonyl arginine hydrochlorid

Specifications & Purity

≥98%

Storage

Argon charged, Room temperature

Shipped In

Normal

Purity

≥98%

Names and Identifiers

• Pubchem Sid: 488198357
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488198357
• Canonical Smiles: C1=CC=C(C=C1)COC(=O)NC(CCCN=C(N)N)C(=O)O.Cl
• IUPAC Name: (2S)-5-(diaminomethylideneamino)-2-(phenylmethoxycarbonylamino)pentanoic acid;hydrochloride
• InChIKey: HHCPMSWPCALFQJ-MERQFXBCSA-N
• INCHI: 1S/C14H20N4O4.ClH/c15-13(16)17-8-4-7-11(12(19)20)18-14(21)22-9-10-5-2-1-3-6-10;/h1-3,5-6,11H,4,7-9H2,(H,18,21)(H,19,20)(H4,15,16,17);1H/t11-;/m0./s1
• Isomeric SMILES: C1=CC=C(C=C1)COC(=O)N[C@@H](CCCN=C(N)N)C(=O)O.Cl
• WGK Germany: 3
• PubChem CID: 13104814
• Molecular Weight: 344.79
• Beilstein: 4622382

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Class Benzene and substituted derivatives
      • Subclass Benzyloxycarbonyls

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Class: Benzene and substituted derivatives
• Subclass: Benzyloxycarbonyls
• Intermediate Tree Nodes: Not available
• Direct Parent: Benzyloxycarbonyls
• Alternative Parents: Alpha amino acids and derivatives Carbamate esters Guanidines Propargyl-type 1,3-dipolar organic compounds Monocarboxylic acids and derivatives Carboxylic acids Carboximidamides Organic oxides Hydrochlorides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Alpha-amino acid or derivatives - Benzyloxycarbonyl - Carbamic acid ester - Guanidine - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Carboximidamide - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organonitrogen compound - Organic oxygen compound - Organic oxide - Organooxygen compound - Hydrocarbon derivative - Carbonyl group - Organic nitrogen compound - Hydrochloride - Aromatic homomonocyclic compound
• Description: This compound belongs to the class of organic compounds known as benzyloxycarbonyls. These are organic compounds containing a carbonyl group substituted with a benzyloxyl group.
• External Descriptors: Not available

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y

Chemical and Physical Properties

• Sensitivity: Moisture sensitive
• Molecular Weight: 344.790 g/mol
• Hydrogen Bond Donor Count: 5
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 9
• Exact Mass: 344.125 Da
• Monoisotopic Mass: 344.125 Da
• Topological Polar Surface Area: 140.000 Ų
• Heavy Atom Count: 23
• Formal Charge: 0
• Complexity: 390.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 1
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 2

XLogP3

References

1. Shan Li, Haifeng Wu, Yuanxi Liu, Baoli Zhang, Shichao Xu, Zhen-Gang Wang.  (2023)  Oxidase-Mimetic Nanocatalyst Based on Geometry-Dependent Biomolecular Self-Assembly.  CHEMISTRY OF MATERIALS,      [PMID:] [10.1021/acs.chemmater.3c02028]