(S)-1-Boc-3-Hydroxypyrrolidine - CAS 101469-92-5
Catalog: |
BB000513 |
Product Name: |
(S)-1-Boc-3-Hydroxypyrrolidine |
CAS: |
101469-92-5 |
Synonyms: |
1-Pyrrolidinecarboxylic acid, 3-hydroxy-, 1,1-dimethylethyl ester, (3S)-; 1-Pyrrolidinecarboxylic acid, 3-hydroxy-, 1,1-dimethylethyl ester, (S)-; (+)-N-Boc-3-hydroxypyrrolidine; (3S)-1-tert-Butoxycarbonyl-3-pyrrolidinol; (3S)-3-Hydroxypyrrolidine-1-carboxylic acid tert-butyl ester; (3S)-Hydroxypyrrolidine-1-carboxylic acid tert-butyl ester; (3S)-N-tert-Butoxycarbonylpyrrolidin-3-ol; (S)-(+)-1-Boc-3-hydroxypyrrolidine; (S)-(+)-N-(tert-Butoxycarbonyl)-3-hydroxypyrrolidine; (S)-(+)-N-(tert-Butoxycarbonyl)-3-pyrrolidinol; (S)-(+)-N-Boc-3-hydroxypyrrolidine; (S)-1-(tert-Butoxycarbonyl)-3-pyrrolidinol; (S)-1-N-Boc-3-pyrrolidinol; (S)-1-tert-Butoxycarbonyl-3-hydroxypyrrolidine; (S)-3-Hydroxy-1-(tert-butoxycarbonyl)pyrrolidine; (S)-3-Hydroxy-1-Boc-pyrrolidine; (S)-3-Hydroxypyrrolidine-1-carboxylic acid tert-butyl ester; (S)-N-(t-Butyloxycarbonyl)-3-hydroxypyrrolidine; (S)-N-(tert-Butoxycarbonyl)-3-hydroxypyrrolidine; (S)-N-Boc-3-hydroxypyrrolidine; (S)-N-Boc-3-pyrrolidinol; (S)-tert-Butyl 3-hydroxypyrrolidine-1-carboxylate; 1,1-Dimethylethyl (3S)-3-hydroxy-1-pyrrolidinecarboxylate; 1,1-Dimethylethyl (3S)-3-hydroxypyrrolidine-1-carboxylate; N-[(tert-Butoxy)carbonyl]-(S)-3-hydroxypyrrolidine; N-Boc-(S)-3-hydroxypyrrolidine; N-tert-Butoxycarbonyl-(S)-3-pyrrolidinol; tert-Butyl (S)-3-hydroxypyrrolidine-1-carboxylate |

Related CAS: | 1220220-64-3 (Deleted CAS)
|
IUPAC Name: | tert-butyl (3S)-3-hydroxypyrrolidine-1-carboxylate |
Description: | (S)-1-Boc-3-Hydroxypyrrolidine, a vital compound employed in pharmaceutical intermediate synthesis for neurological disorder and cancer treatment. It serves as a fundamental component in drug fabrication to combat diverse diseases with precision and efficacy. |
Molecular Weight: | 187.24 |
Molecular Formula: | C9H17NO3 |
Canonical SMILES: | CC(C)(C)OC(=O)N1CCC(C1)O |
InChI: | InChI=1S/C9H17NO3/c1-9(2,3)13-8(12)10-5-4-7(11)6-10/h7,11H,4-6H2,1-3H3/t7-/m0/s1 |
InChI Key: | APCBTRDHCDOPNY-ZETCQYMHSA-N |
Boiling Point: | 273.3±33.0°C at 760 mmHg |
Melting Point: | 60-61°C |
Purity: | ≥95% |
Density: | 1.142±0.06 g/cm3 |
Solubility: | Soluble in Methanol |
Appearance: | White to Pale Yellow Crystalline Powder |
Storage: | Store at RT |
MDL: | MFCD01317839 |
LogP: | 0.92600 |
GHS Hazard Statement: | H301 (83.33%): Toxic if swallowed [Danger Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P310, P302+P352, P304+P340, P305+P351+P338, P310, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
CN-112341464-A | Halogen-substituted Latricinib compound | 20201015 |
CN-111518007-A | Synthesis method of (S) -3-pyrrolidinol hydrochloride | 20200430 |
WO-2021167882-A1 | Antiviral compounds | 20200218 |
WO-2021154966-A1 | Compounds and compositions for use in treating skin disorders | 20200129 |
US-2021214366-A1 | Bicyclic heterocycles as fgfr inhibitors | 20200115 |
Complexity: | 198 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 1 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 187.12084340 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 187.12084340 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 49.8 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.6 |
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