tert-butyl N-[1-(4-aminophenyl)azetidin-3-yl]carbamate - ≥97% , CAS No.889948-10-1

CAS: 889948-10-1 Cat. No.: T634980 Molecular Weight: 263.33 PubChem CID: 90477298

GRADE & PURITY ≥97%

Synonyms

889948-10-1 | 4-[(3-N-Boc-aminoazetidin-1-yl)]aniline | TERT-BUTYL N-[1-(4-AMINOPHENYL)AZETIDIN-3-YL]CARBAMATE | [1-(4-amino-phenyl)-azetidin-3-yl]-cabamicacidtert-butylester | 4-((3-n-boc-aminoazetidin-1-yl))aniline | MFCD06657372 | P18337 | EN300-124146

Storage

Room temperature

Shipped In

Normal

Specifications

Synonyms

889948-10-1 | 4-[(3-N-Boc-aminoazetidin-1-yl)]aniline | TERT-BUTYL N-[1-(4-AMINOPHENYL)AZETIDIN-3-YL]CARBAMATE | [1-(4-amino-phenyl)-azetidin-3-yl]-cabamicacidtert-butylester | 4-((3-n-boc-aminoazetidin-1-yl))aniline | MFCD06657372 | P18337 | EN300-124146

Specifications & Purity

≥97%

Storage

Room temperature

Shipped In

Normal

Purity

≥97%

Names and Identifiers

• Canonical Smiles: CC(C)(C)OC(=O)NC1CN(C1)C2=CC=C(C=C2)N
• IUPAC Name: tert-butyl N-[1-(4-aminophenyl)azetidin-3-yl]carbamate
• InChIKey: HVVRSUVDZYKWCV-UHFFFAOYSA-N
• INCHI: 1S/C14H21N3O2/c1-14(2,3)19-13(18)16-11-8-17(9-11)12-6-4-10(15)5-7-12/h4-7,11H,8-9,15H2,1-3H3,(H,16,18)
• PubChem CID: 90477298
• Molecular Weight: 263.33

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Class Azetidines
      • Subclass Phenylazetidines

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Class: Azetidines
• Subclass: Phenylazetidines
• Intermediate Tree Nodes: Not available
• Direct Parent: Phenylazetidines
• Alternative Parents: Dialkylarylamines Aniline and substituted anilines Carbamate esters Azacyclic compounds Primary amines Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: 1-phenylazetidine - Tertiary aliphatic/aromatic amine - Aniline or substituted anilines - Dialkylarylamine - Monocyclic benzene moiety - Benzenoid - Carbamic acid ester - Tertiary amine - Azacycle - Hydrocarbon derivative - Amine - Organic oxide - Primary amine - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Carbonyl group - Organic nitrogen compound - Aromatic heteromonocyclic compound
• Description: This compound belongs to the class of organic compounds known as phenylazetidines. These are polycyclic aromatic compounds containing a phenyl ring substituted with an azetidine ring.
• 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