| Pubchem Sid | 504757740 |
|---|---|
| Pubchem Sid Url | https://pubchem.ncbi.nlm.nih.gov/substance/504757740 |
| Sonrisas canónicas | CC(C)(C)OC(=O)NCCN.Cl |
| IUPAC Name | tert-butyl N-(2-aminoethyl)carbamate;hydrochloride |
| InChIKey | XUHJJLCKXZTUJN-UHFFFAOYSA-N |
| INCHI | 1S/C7H16N2O2.ClH/c1-7(2,3)11-6(10)9-5-4-8;/h4-5,8H2,1-3H3,(H,9,10);1H |
| Isómeros SMILES | CC(C)(C)OC(=O)NCCN.Cl |
| Peso molecular | 196.68 |
| Beilstein | 3627511 |
| Reaxy-Rn | 3627511 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=3627511&ln= |
Comprehensive hazard, handling, storage, and regulatory compliance document.
Download SDS →Lot-specific quality data. Enter your lot number to retrieve the exact COA.
Look up COA →Full quality attributes and acceptance criteria for this grade.
View spec sheet →Taxonomy Tree
| Kingdom | Organic compounds |
|---|---|
| Superclass | Organic acids and derivatives |
| Clase | 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 Organic oxides Monoalkylamines Hydrochlorides Hydrocarbon derivatives Carbonyl compounds |
| Molecular Framework | Aliphatic acyclic compounds |
| Substituents | Carbamic acid ester - Carbonic acid derivative - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Hydrochloride - Primary amine - Organooxygen compound - Organonitrogen compound - Primary aliphatic amine - Carbonyl group - Amine - Aliphatic acyclic compound |
| Descripción | 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 |
Find and download the COA for your product by matching the lot number on the packaging.
| Lot Number | Certificate Type | Fecha | Articulo |
|---|---|---|---|
 H1809149 | Certificate of Analysis | Mar 20, 2026 | B123469 |
| H1809150 | Certificate of Analysis | Mar 20, 2026 | B123469 |
| G1812058 | Certificate of Analysis | Feb 05, 2026 | B123469 |
| K2223157 | Certificate of Analysis | Jul 28, 2022 | B123469 |
| K2223158 | Certificate of Analysis | Jul 28, 2022 | B123469 |
| K2223162 | Certificate of Analysis | Jul 28, 2022 | B123469 |
| Sensibilidad | Hygroscopic |
|---|---|
| Punto de fusión (°C) | 148-151°C |
| Peso molecular | 196.670 g/mol |
| XLogP3 | |
| Hydrogen Bond Donor Count | 3 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 4 |
| Exact Mass | 196.098 Da |
| Monoisotopic Mass | 196.098 Da |
| Topological Polar Surface Area | 64.400 Ų |
| Heavy Atom Count | 12 |
| Formal Charge | 0 |
| Complexity | 129.000 |
| 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 | 2 |
| 1. Yuan-Fu Ding, Cheryl H. T. Kwong, Shengke Li, Ya-Ting Pan, Jianwen Wei, Lian-Hui Wang, Greta S. P. Mok, Ruibing Wang. (2021) Supramolecular nanomedicine derived from cucurbit[7]uril-conjugated nano-graphene oxide for multi-modality cancer therapy. Biomaterials Science, 9 (10): (3804-3813). [PMID:33881050] [10.1039/D1BM00426C] |
