Carbamic acid, (3R)-3-pyrrolidinyl-, 1,1-dimethylethyl ester


Chemical Name: Carbamic acid, (3R)-3-pyrrolidinyl-, 1,1-dimethylethyl ester
CAS Number: 122536-77-0
Product Number: AG0032F2(AGN-PC-0O0FF4)
Synonyms:
MDL No: MFCD00143191
Molecular Formula: C9H18N2O2
Molecular Weight: 186.2514

Identification/Properties


Properties
MP:
50 °C
BP:
286.4 °C at 760mmHg
Storage:
Keep in dry area;Room Temperature;
Form:
Solid
Stability:
Air Sensitive
Refractive Index:
20 ° (C=1, EtOH)
Computed Properties
Molecular Weight:
186.255g/mol
XLogP3:
0.7
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
3
Exact Mass:
186.137g/mol
Monoisotopic Mass:
186.137g/mol
Topological Polar Surface Area:
50.4A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
187
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
1
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
N/A
Hazard Statements:
H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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Chemical Structure



The (R)-3-(tert-Butoxycarbonylamino)pyrrolidine compound is a valuable building block in chemical synthesis, particularly in the field of organic chemistry. This compound is commonly used as a chiral reagent due to its unique stereochemistry, making it ideal for asymmetric synthesis processes. Its tert-butoxycarbonyl (Boc) protecting group provides stability and allows for selective manipulation of functional groups during reactions. (R)-3-(tert-Butoxycarbonylamino)pyrrolidine is frequently employed in the preparation of pharmaceuticals, agrochemicals, and other fine chemicals where chirality plays a crucial role in determining the biological activity or properties of the end product. This compound's versatile nature and ability to facilitate the creation of enantiopure molecules make it a valuable tool for chemists working in the synthesis of complex organic compounds.