GRADE & PURITY ≥97%

Synonyms

Z-Thr-NH2 | PYZXYZOBPGPOFQ-SCZZXKLOSA-N | benzyl ((2S,3R)-1-amino-3-hydroxy-1-oxobutan-2-yl)carbamate | Z-Thr-NH2, >=99.0% (HPLC) | Carbobenzoxy-L-threonine amide | Z-L-threonine amide | SCHEMBL9383939 | benzyl N-[(1S,2R)-1-carbamoyl-2-hydroxypropyl]carba

Storage

Store at -20°C

Shipped In

Ice chest + Ice pads

Specifications

Synonyms

Z-Thr-NH2 | PYZXYZOBPGPOFQ-SCZZXKLOSA-N | benzyl ((2S, 3R)-1-amino-3-hydroxy-1-oxobutan-2-yl)carbamate | Z-Thr-NH2, >=99.0% (HPLC) | Carbobenzoxy-L-threonine amide | Z-L-threonine amide | SCHEMBL9383939 | benzyl N-[(1S, 2R)-1-carbamoyl-2-hydroxypropyl]carba

Specifications & Purity

≥97%

Storage

Store at -20°C

Shipped In

Ice chest + Ice pads

This product requires cold chain shipping. Ground and other economy services are not available.

Purity

≥97%

Names and Identifiers

• Pubchem Sid: 504764530
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504764530
• Canonical Smiles: CC(C(C(=O)N)NC(=O)OCC1=CC=CC=C1)O
• IUPAC Name: benzyl N-[(2S,3R)-1-amino-3-hydroxy-1-oxobutan-2-yl]carbamate
• InChIKey: PYZXYZOBPGPOFQ-SCZZXKLOSA-N
• INCHI: 1S/C12H16N2O4/c1-8(15)10(11(13)16)14-12(17)18-7-9-5-3-2-4-6-9/h2-6,8,10,15H,7H2,1H3,(H2,13,16)(H,14,17)/t8-,10+/m1/s1
• Isomeric SMILES: C[C@H]([C@@H](C(=O)N)NC(=O)OCC1=CC=CC=C1)O
• WGK Germany: 3
• PubChem CID: 7010574
• Molecular Weight: 252.27
• Beilstein: 2335408

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 Fatty amides Carbamate esters Secondary alcohols Primary carboxylic acid amides Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: N-substituted-alpha-amino acid - Alpha-amino acid or derivatives - Benzyloxycarbonyl - Fatty amide - Fatty acyl - Carbamic acid ester - Secondary alcohol - Primary carboxylic acid amide - Carboxamide group - Carboxylic acid derivative - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Carbonyl group - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Alcohol - 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

• Molecular Weight: 252.270 g/mol
• XLogP3: 0.300
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 6
• Exact Mass: 252.111 Da
• Monoisotopic Mass: 252.111 Da
• Topological Polar Surface Area: 102.000 Ų
• Heavy Atom Count: 18
• Formal Charge: 0
• Complexity: 290.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 2
• 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: 1