Boc-cis-3-hydroxy-l-proline - CAS 186132-96-7
Catalog: |
BB054642 |
Product Name: |
Boc-cis-3-hydroxy-l-proline |
CAS: |
186132-96-7 |
Synonyms: |
(2S,3R)-1-(tert-Butoxycarbonyl)-3-hydroxypyrrolidine-2-carboxylic acid; (2S,3R)-3-hydroxy-pyrrolidine-1,2-dicarboxylic acid 1-tert-butyl ester; cis-1-(Tert-butoxycarbonyl)-3-hydroxypyrrolidine-2-carboxylic acid; N-boc-cis-3-hydroxy-L-proline |
IUPAC Name: | (2S,3R)-3-hydroxy-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-2-carboxylic acid |
Molecular Weight: | 231.25 |
Molecular Formula: | C10H17NO5 |
Canonical SMILES: | CC(C)(C)OC(=O)N1CCC(C1C(=O)O)O |
InChI: | InChI=1S/C10H17NO5/c1-10(2,3)16-9(15)11-5-4-6(12)7(11)8(13)14/h6-7,12H,4-5H2,1-3H3,(H,13,14)/t6-,7+/m1/s1 |
InChI Key: | JLDHXHPQMBNKMC-RQJHMYQMSA-N |
Boiling Point: | 390.9±42.0 °C at 760 mmHg |
Purity: | 95% |
Density: | 1.312±0.06 g/cm3 |
Storage: | Store at RT |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]; H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]; H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation] |
Precautionary Statement: | P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 |
Signal Word: | Warning |
Complexity: | 296 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 2 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 231.11067264 |
Formal Charge: | 0 |
Heavy Atom Count: | 16 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 231.11067264 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 87.1 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.8 |
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Pyrrolidines
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