tert-Butyl ((3R,4R)-4-methylpyrrolidin-3-yl)carbamate - CAS 107610-69-5
Catalog: |
BB070968 |
Product Name: |
tert-Butyl ((3R,4R)-4-methylpyrrolidin-3-yl)carbamate |
CAS: |
107610-69-5 |
Synonyms: |
(3S,4S)-3-(Boc-amino)-4-methylpyrrolidine; TERT-BUTYL (3S,4S)-4-METHYLPYRROLIDIN-3-YLCARBAMATE; (3S,4S)-(4-Methyl-pyrrolidin-3-yl)-carbamic acid tert-butyl ester; tert-Butyl ((3S,4S)-4-methylpyrrolidin-3-yl)carbamate; TERT-BUTYL N-[(3S,4S)-4-METHYLPYRROLIDIN-3-YL]CARBAMATE; Carbamic acid, [(3S,4S)-4-methyl-3-pyrrolidinyl]-, 1,1-dimethylethyl ester (9CI) |
IUPAC Name: | tert-butyl N-[(3S,4S)-4-methylpyrrolidin-3-yl]carbamate |
Molecular Weight: | 200.28 |
Molecular Formula: | C10H20N2O2 |
Canonical SMILES: | CC1CNCC1NC(=O)OC(C)(C)C |
InChI: | InChI=1S/C10H20N2O2/c1-7-5-11-6-8(7)12-9(13)14-10(2,3)4/h7-8,11H,5-6H2,1-4H3,(H,12,13)/t7-,8+/m0/s1 |
InChI Key: | BKITXDSDJGOXPN-JGVFFNPUSA-N |
Complexity: | 211 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 2 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 200.152477885 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 200.152477885 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 50.4Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.1 |
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