Boc-D-prolinol - CAS 83435-58-9
Catalog: |
BB037027 |
Product Name: |
Boc-D-prolinol |
CAS: |
83435-58-9 |
Synonyms: |
Boc-D-Pro-ol; N-tert-butoxycarbonyl-D-prolinol; N-Boc-D-prolinol; (R)-tert-butyl 2-(hydroxymethyl)pyrrolidine-1-carboxylate; (R)-(+)-1-Boc-2-pyrrolidinemethanol; 1-Boc-D-Prolinol; (R)-(+)-1-(tert-Butoxycarbonyl)-2-pyrrolidinemethanol; N-t-Boc-D-prolinol; 1-Pyrrolidinecarboxylic acid, 2-(hydroxymethyl)-, 1,1-dimethylethyl ester, (2R)- |
Related CAS: | 59378-81-3 (rac-isomer)
|
IUPAC Name: | tert-butyl (2R)-2-(hydroxymethyl)pyrrolidine-1-carboxylate |
Description: | N-Boc-D-prolinol (CAS# 83435-58-9) is used to prepare (azetidinyl)methoxy]pyridines and 2-(aryloxymethyl) azacyclic analogs with therapeutic potetials for the treatment of central nervous system (CNS) disorders. |
Molecular Weight: | 201.26 |
Molecular Formula: | C10H19NO3 |
Canonical SMILES: | CC(C)(C)OC(=O)N1CCCC1CO |
InChI: | InChI=1S/C10H19NO3/c1-10(2,3)14-9(13)11-6-4-5-8(11)7-12/h8,12H,4-7H2,1-3H3/t8-/m1/s1 |
InChI Key: | BFFLLBPMZCIGRM-MRVPVSSYSA-N |
Boiling Point: | 289.5±13.0°C (Predicted) |
Melting Point: | 60-64°C |
Purity: | ≥95% |
Density: | 1.084±0.06 g/cm3 (Predicted) |
Solubility: | Soluble in Methanol; Insoluble in Water |
Appearance: | White to Light Beige Crystalline Powder |
Storage: | Store at RT |
MDL: | MFCD00040580 |
LogP: | 1.31610 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-113493628-A | Quantum dot ink and preparation method of quantum dot film | 20200318 |
WO-2021178420-A1 | Compounds targeting rna-binding proteins or rna-modifying proteins | 20200303 |
CN-113122053-A | Quantum dot ink and preparation method of quantum dot film | 20191230 |
CN-111018767-A | Preparation method of D-proline derivative and intermediate thereof | 20191223 |
CN-111018767-B | Preparation method of D-proline derivative and intermediate thereof | 20191223 |
PMID | Publication Date | Title | Journal |
22985961 | 20121015 | Synthesis and pharmacological investigation of azaphthalazinone human histamine H(1) receptor antagonists | Bioorganic & medicinal chemistry |
Complexity: | 210 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 1 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 201.13649347 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 201.13649347 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 49.8 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1 |
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