tert-butyl (3R)-3-aminopyrrolidine-1-carboxylate - CAS 147081-49-0
Catalog: |
BB010155 |
Product Name: |
tert-butyl (3R)-3-aminopyrrolidine-1-carboxylate |
CAS: |
147081-49-0 |
Synonyms: |
1-Pyrrolidinecarboxylic acid, 3-amino-, 1,1-dimethylethyl ester, (3R)-; 1-Pyrrolidinecarboxylic acid, 3-amino-, 1,1-dimethylethyl ester, (R)-; (+)-3-Aminopyrrolidine-1-carboxylic acid (R)-tert-butyl ester; (3R)-(+)-1-(tert-Butoxycarbonyl)-3-aminopyrrolidine; (3R)-3-Aminopyrrolidine-1-carboxylic acid tert-butyl ester; (R)-(+)-1-Boc-3-aminopyrrolidine; (R)-(+)-3-Amino-1-(tert-butoxycarbonyl)pyrrolidine; (R)-(+)-N-Boc-3-aminopyrrolidine; (R)-1-(tert-Butoxycarbonyl)-3-aminopyrrolidine; (R)-1-Boc-3-aminopyrrolidine; (R)-3-Amino-1-(tert-butoxycarbonyl)pyrrolidine; (R)-3-Amino-1-Boc-pyrrolidine; (R)-3-Amino-1-tert-butoxycarbonylpyrrolidine; (R)-3-Amino-N-(tert-butoxycarbonyl)pyrrolidine; (R)-3-Aminopyrrolidine-1-carboxylic acid tert-butyl ester; (R)-N-Boc-3-aminopyrrolidine; (R)-N-tert-Butoxycarbonyl-3-aminopyrrolidine; (R)-tert-Butyl 3-aminopyrrolidine-1-carboxylate; 1,1-Dimethylethyl (3R)-3-amino-1-pyrrolidinecarboxylate; 1,1-dimethylethyl (3R)-3-aminopyrrolidine-1-carboxylate; 1-Boc-(R)-3-aminopyrrolidine; 1-N-Boc-3-(R)-aminopyrrolidine; 3-Aminopyrrolidine-1-carboxylic acid (R)-tert-butyl ester; N-Boc-(3R)-aminopyrrolidine; tert-Butyl (R)-3-amino-1-pyrrolidinecarboxylate; tert-Butyl (R)-3-aminopyrrolidine-1-carboxylate |
Related CAS: | 1220220-51-8 (Deleted CAS)
|
IUPAC Name: | tert-butyl (3R)-3-aminopyrrolidine-1-carboxylate |
Description: | tert-butyl (3R)-3-aminopyrrolidine-1-carboxylate plays a vital role in the intricate process of drug development, particularly in the creation of therapeutic agents for complex ailments such as neurodegenerative conditions and malignant tumors. By serving as a crucial building block in the fabrication of pharmacological entities designed to interact with precise biological targets, this compound demonstrates remarkable versatility and potential in the field of medicinal chemistry. |
Molecular Weight: | 186.25 |
Molecular Formula: | C9H18N2O2 |
Canonical SMILES: | CC(C)(C)OC(=O)N1CCC(C1)N |
InChI: | InChI=1S/C9H18N2O2/c1-9(2,3)13-8(12)11-5-4-7(10)6-11/h7H,4-6,10H2,1-3H3/t7-/m1/s1 |
InChI Key: | CMIBWIAICVBURI-SSDOTTSWSA-N |
Boiling Point: | 257.4±33.0°C at 760 mmHg |
Melting Point: | 58.0-59.8°C |
Purity: | ≥95% |
Density: | 1.067±0.06 g/cm3 |
Solubility: | Soluble in Dichloromethane |
Appearance: | Light Yellow to Colorless Liquid |
Storage: | Store at 2-8°C under inert atmosphere |
MDL: | MFCD03419272 |
LogP: | 1.59270 |
GHS Hazard Statement: | H301 (82%): Toxic if swallowed [Danger Acute toxicity, oral] |
Precautionary Statement: | P264, P270, P280, P301+P310, P302+P352, P305+P351+P338, P310, P321, P330, P332+P313, P337+P313, P362, P405, and P501 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
WO-2021102299-A1 | Caspase 6 inhibitors and uses thereof | 20191122 |
WO-2021078021-A1 | Small molecular compound | 20191024 |
WO-2021057998-A1 | Preparation method for pyrroloaminopyridazinone compound | 20190929 |
WO-2021057915-A1 | Ep300/cbp inhibitor | 20190927 |
WO-2021032935-A1 | Enzyme inhibitors | 20190821 |
Complexity: | 198 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 1 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 186.136827821 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 186.136827821 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 55.6 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.4 |
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