N-Boc-6-bromohexylamine - ≥97%(GC) , CAS No.142356-33-0

CAS: 142356-33-0 Cat. No.: T132242 Molecular Weight: 280.20 EC Number: 627-894-0 PubChem CID: 16211353

GRADE & PURITY ≥97%(GC)

Synonyms

6-(Boc-amino)hexyl bromide | 6-(BOC-AMINO)-HEXYL BROMIDE | SY018081 | tert-Butyl N-(6-bromohexyl)carbamate | 6-(Boc-amino)hexyl bromide, >=97.0% (GC) | SCHEMBL1041731 | EN300-7422201 | Boc-NH-C6-Br | N-Boc-6-bromohexylamine | N-Boc-6-Bromo-hexylamine | Q-

Storage

Store at 2-8°C,Argon charged

Shipped In

Wet ice

Specifications

Synonyms

6-(Boc-amino)hexyl bromide | 6-(BOC-AMINO)-HEXYL BROMIDE | SY018081 | tert-Butyl N-(6-bromohexyl)carbamate | 6-(Boc-amino)hexyl bromide, >=97.0% (GC) | SCHEMBL1041731 | EN300-7422201 | Boc-NH-C6-Br | N-Boc-6-bromohexylamine | N-Boc-6-Bromo-hexylamine | Q-

Specifications & Purity

≥97%(GC)

Storage

Store at 2-8°C, Argon charged

Shipped In

Wet ice

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

Purity

≥97%(GC)

Names and Identifiers

• Pubchem Sid: 504768101
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504768101
• Canonical Smiles: CC(C)(C)OC(=O)NCCCCCCBr
• IUPAC Name: tert-butyl N-(6-bromohexyl)carbamate
• InChIKey: NXQXVXILNVTMNA-UHFFFAOYSA-N
• INCHI: 1S/C11H22BrNO2/c1-11(2,3)15-10(14)13-9-7-5-4-6-8-12/h4-9H2,1-3H3,(H,13,14)
• Isomeric SMILES: CC(C)(C)OC(=O)NCCCCCCBr
• WGK Germany: 3
• PubChem CID: 16211353
• Molecular Weight: 280.20

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic acids and derivatives
    • Class Carboxylic acids and derivatives
      • Subclass Amino acids, peptides, and analogues
        • Level5 Amino acids and derivatives
          • Level6 Carbamic acids and derivatives
            • Level7 Carbamate esters

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• Class: Carboxylic acids and derivatives
• Subclass: Amino acids, peptides, and analogues
• Intermediate Tree Nodes: Amino acids and derivatives - Carbamic acids and derivatives
• Direct Parent: Carbamate esters
• Alternative Parents: Organic carbonic acids and derivatives Organopnictogen compounds Organonitrogen compounds Organobromides Organic oxides Hydrocarbon derivatives Carbonyl compounds Alkyl bromides
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Carbamic acid ester - Carbonic acid derivative - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organobromide - Organohalogen compound - Carbonyl group - Alkyl halide - Alkyl bromide - Aliphatic acyclic compound
• Description: This compound belongs to the class of organic compounds known as carbamate esters. These are compounds containing an ester of carbamic acid with the general structure R2NC(=O)OR' (R' not H). They are esters of carbamic acids.
• 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

• Refractive Index: 1.473
• Molecular Weight: 280.200 g/mol
• XLogP3: 3.100
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 8
• Exact Mass: 279.083 Da
• Monoisotopic Mass: 279.083 Da
• Topological Polar Surface Area: 38.300 Ų
• Heavy Atom Count: 15
• Formal Charge: 0
• Complexity: 178.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• 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

References

1. Kai Wang, Wentao Zhou, Xiangyu Jin, Xuwei Shang, Xiaomei Wu, Lijuan Wen, Sufen Li, Yiling Hong, Jia Ke, Yichong Xu, Hong Yuan, Fuqiang Hu.  (2023)  Enhanced brain delivery of hypoxia-sensitive liposomes by hydroxyurea for rescue therapy of hyperacute ischemic stroke.  Nanoscale,  15  (27): (11625-11646).  [PMID:37377137] [10.1039/D3NR01071F]

2. Meng Tingting, Li Yinghong, Tian Ying, Ma Mingxing, Shi Kequan, Shang Xuwei, Yuan Hong, Hu Fuqiang.  (2022)  A Hypoxia-Sensitive Drug Delivery System Constructed by Nitroimidazole and its Application in the Treatment of Hepatocellular Carcinoma.  AAPS PHARMSCITECH,  23  (6): (1-11).  [PMID:35711068] [10.1208/s12249-022-02316-7]

3. Chenlong Wei, Xinzhu Shan, Yuxuan Huang, Bin Ma, Zhiqiang Zhao, Yian Fang, Chengrui Bai, Zihan Zhang, Peng Zhao, Huijuan Zhang, Yu Hou, Tianjiao Ji, Zhongtang Li, Song Song, Fei Xie, Lei Miao.  (2026)  FAP-Synergistic Organ-Targeted mRNA-LNP for Overcoming Delivery Barriers in Hepatic and Pulmonary Fibrosis.  Journal of the American Chemical Society,      [PMID:41731656] [10.1021/jacs.5c16886]