rac 1-POC-3-methylaminopyrrolidine - CAS 1546068-28-3
Catalog: |
BB058070 |
Product Name: |
rac 1-POC-3-methylaminopyrrolidine |
CAS: |
1546068-28-3 |
Synonyms: |
3-(Methylamino)-1-pyrrolidinecarboxylic Acid 1-Methylethyl Ester |
IUPAC Name: | propan-2-yl 3-(methylamino)pyrrolidine-1-carboxylate |
Description: | rac 1-POC-3-methylaminopyrrolidine is a compound that can be synthesized from 3-Hydroxypyrrolidine Hydrochloride (H953673). |
Molecular Weight: | 186.25 |
Molecular Formula: | C9H18N2O2 |
Canonical SMILES: | CC(C)OC(=O)N1CCC(C1)NC |
InChI: | InChI=1S/C9H18N2O2/c1-7(2)13-9(12)11-5-4-8(6-11)10-3/h7-8,10H,4-6H2,1-3H3 |
InChI Key: | VYJKGRHBRIKLMJ-UHFFFAOYSA-N |
Complexity: | 183 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
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: | 3 |
Topological Polar Surface Area: | 41.6Ų |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.7 |
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