1-Acetyl-3-(BOC-Amino)pyrrolidine - CAS 881298-14-2
Catalog: |
BB075593 |
Product Name: |
1-Acetyl-3-(BOC-Amino)pyrrolidine |
CAS: |
881298-14-2 |
Synonyms: |
1-Acetyl-3-(BOC-Amino)pyrrolidine; tert-butyl N-(1-acetylpyrrolidin-3-yl)carbamate; tert-butyl 1-acetyl-3-pyrrolidinylcarbamate |
IUPAC Name: | tert-butyl N-(1-acetylpyrrolidin-3-yl)carbamate |
Description: | 1-Acetyl-3-(BOC-Amino)pyrrolidine |
Molecular Weight: | 228.29 |
Molecular Formula: | C11H20N2O3 |
Canonical SMILES: | CC(=O)N1CCC(C1)NC(=O)OC(C)(C)C |
InChI: | InChI=1S/C11H20N2O3/c1-8(14)13-6-5-9(7-13)12-10(15)16-11(2,3)4/h9H,5-7H2,1-4H3,(H,12,15) |
InChI Key: | LCOCMEGQRKOYAP-UHFFFAOYSA-N |
Complexity: | 283 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 228.1473925 |
Formal Charge: | 0 |
Heavy Atom Count: | 16 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 228.1473925 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 58.6Ų |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.6 |
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