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Z-ARG(Z)2-OH structure
Z-ARG(Z)2-OH structure

Z-ARG(Z)2-OH

Iupac Name:(2R)-2-(phenylmethoxycarbonylamino)-5-[phenylmethoxycarbonyl-(N'-phenylmethoxycarbonylcarbamimidoyl)amino]pentanoic acid
CAS No.: 14611-34-8
Molecular Weight:576.606
Modify Date.: 2023-04-07 06:54
Introduction:

White to off-white powder

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1. Names and Identifiers
1.1 Name
Z-ARG(Z)2-OH
1.2 Synonyms

(Cbz)3Arg-OH (S)-2-(((Benzyloxy)carbonyl)amino)-5-(1,3-bis((benzyloxy)carbonyl)guanidino)pentanoic acid 2-Oxa-4,6,11-triazadodecan-12-oic acid, 10-carboxy-5-imino-3-oxo-1-phenyl-6-((phenylmethoxy)carbonyl)-, 12-(phenylmethyl) ester, (10S)- 2-Oxa-4,6,11-triazadodecan-12-oic acid, 10-carboxy-5-imino-3-oxo-1-phenyl-6-((phenylmethoxy)carbonyl)-, 12-(phenylmethyl) ester, (S)- Benzyl N2,N2-bis[(benzyloxy)carbonyl]-2-carboxyargininate CBZ-ARG(CBZ)2-OH Cbz-Arg(Z)2-OH L-Ornithine, N-[(E)-amino[[(phenylmethoxy)carbonyl]imino]methyl]-N,N-bis[(phenylmethoxy)carbonyl]- L-Ornithine, N-[imino[[(phenylmethoxy)carbonyl]amino]methyl]-N,N-bis[(phenylmethoxy)carbonyl]- L-Ornithine, N5-(imino(((phenylmethoxy)carbonyl)amino)methyl)-N2,N5-bis((phenylmethoxy)carbonyl)- N,N-Bis[(benzyloxy)carbonyl]-N-{N'-[(benzyloxy)carbonyl]carbamimidoyl}-L-ornithine N,N-Bis[(benzyloxy)carbonyl]-N-{N-[(benzyloxy)carbonyl]carbamimidoyl}-L-ornithine N5-(Imino(((phenylmethoxy)carbonyl)amino)methyl)-N2,N5-bis((phenylmethoxy)carbonyl)-L-ornithine N-ALPHA ,N-OMEGA1,N-OMEGA2-TRI CARBOBENZOXY-L-ARGININE SODIUM SALT N-ALPHA,N-DELTA,N-OMEGA-TRIBENZYLOXYCARBONYL-L-ARGININE N-ALPHA,N-DELTA,N-OMEGA-TRI-Z-L-ARGININE N-ALPHA,NG,NG-TRI-CBZ-L-ARGININE N-ALPHA,N-OMEGA,N-OMEGA'-TRIS-Z-L-ARGININE N-ALPHA,N-OMEGA1,N-OMEGA2-TRI CARBOBENZOXY-L-ARGININE Propanedioic acid, 2-[3-[(aminoiminomethyl)amino]propyl]-2-[bis[(phenylmethoxy)carbonyl]amino]-, mono(phenylmethyl) ester Tri-Cbz-L-Arginine Tris(benzyloxycarbonyl)arginine Tris(carbobenzoxy)-L-arginine tris-Z-arginine TRI-Z-D-ARGININE TRI-Z-L-ARGININE Z-ARG(DI-Z)-OH Z-Arg(Z2)-OH Z-ARGININE(Z)2-OH Z-L-ARG(Z2)-OH

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1.3 CAS No.
14611-34-8
1.4 CID
92222587
1.5 EINECS(EC#)
238-647-8
1.6 Molecular Formula
C30H32N4O8 (isomer)
1.7 Inchi
InChI=1S/C30H32N4O8/c31-27(33-29(38)41-20-23-13-6-2-7-14-23)34(30(39)42-21-24-15-8-3-9-16-24)18-10-17-25(26(35)36)32-28(37)40-19-22-11-4-1-5-12-22/h1-9,11-16,25H,10,17-21H2,(H,32,37)(H,35,36)(H2,31,33,38)/t25-/m1/s1
1.8 InChIkey
YSGAXJCIEJGVFV-RUZDIDTESA-N
1.9 Canonical Smiles
C1=CC=C(C=C1)COC(=O)NC(CCCN(C(=NC(=O)OCC2=CC=CC=C2)N)C(=O)OCC3=CC=CC=C3)C(=O)O
1.10 Isomers Smiles
C1=CC=C(C=C1)COC(=O)N[C@H](CCCN(C(=NC(=O)OCC2=CC=CC=C2)N)C(=O)OCC3=CC=CC=C3)C(=O)O
2. Properties
2.1 Density
1.27
2.1 Melting point
137-140°C
2.1 Boiling point
°Cat760mmHg
2.1 Refractive index
1.595
2.1 Flash Point
°C
2.1 Precise Quality
576.22200
2.1 PSA
167.35000
2.1 logP
5.52770
2.1 Appearance
Solid
2.2 Storage
-15°C
2.3 Chemical Properties
White to off-white powder Z-ARG(Z)2-OHSupplier
2.4 pKa
3.94±0.21(Predicted)
2.5 StorageTemp
-15°C
3. MSDS

2.Hazard identification

2.1 Classification of the substance or mixture

no data available

2.2 GHS label elements, including precautionary statements

Pictogram(s) no data available
Signal word

no data available

Hazard statement(s)

no data available

Precautionary statement(s)
Prevention

no data available

Response

no data available

Storage

no data available

Disposal

no data available

2.3 Other hazards which do not result in classification

no data available

7. Other Information
7.0 Chemical Properties
White to off-white powder
7.1 Uses
Tris(carbobenzoxy)-L-arginine is a protected L-argenine derivative used in the preparation of synthetic peptides and amides, such as argiopine.
7.2 用途

NSC-120011, also known as Tris(benzyloxycarbonyl)arginine, is a bioactive chemical.
8. Computational chemical data
  • Molecular Weight: 576.606g/mol
  • Molecular Formula: C30H32N4O8
  • Compound Is Canonicalized: True
  • XLogP3-AA: 4.9
  • Exact Mass: 576.22201399
  • Monoisotopic Mass: 576.22201399
  • Complexity: 896
  • Rotatable Bond Count: 16
  • Hydrogen Bond Donor Count: 3
  • Hydrogen Bond Acceptor Count: 8
  • Topological Polar Surface Area: 170
  • Heavy Atom Count: 42
  • Defined Atom Stereocenter Count: 1
  • Undefined Atom Stereocenter Count: 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 1
  • Isotope Atom Count: 0
  • Covalently-Bonded Unit Count: 1
  • CACTVS Substructure Key Fingerprint: AAADcfB7vAAAAAAAAAAAAAAAAAAAAAAAAAAwYMAAAAAAAAABUAAAHgAQCAAADCjhmAYxCIPABgCoAiDSPAACAAEgAAAJiIGICImKJjKAuTiMcAAk1wMYqAeY0SIOAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA==
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