trans-1-Boc-pyrrolidine-3,4-dicarboxylic Acid - CAS 865451-68-9
Catalog: |
BB037982 |
Product Name: |
trans-1-Boc-pyrrolidine-3,4-dicarboxylic Acid |
CAS: |
865451-68-9 |
Synonyms: |
1-[(2-methylpropan-2-yl)oxy-oxomethyl]pyrrolidine-3,4-dicarboxylic acid; 1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-3,4-dicarboxylic acid |
IUPAC Name: | (3R,4R)-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-3,4-dicarboxylic acid |
Description: | trans-1-Boc-pyrrolidine-3,4-dicarboxylic Acid (CAS# 865451-68-9) is a useful research chemical. |
Molecular Weight: | 259.26 |
Molecular Formula: | C11H17NO6 |
Canonical SMILES: | CC(C)(C)OC(=O)N1CC(C(C1)C(=O)O)C(=O)O |
InChI: | InChI=1S/C11H17NO6/c1-11(2,3)18-10(17)12-4-6(8(13)14)7(5-12)9(15)16/h6-7H,4-5H2,1-3H3,(H,13,14)(H,15,16) |
InChI Key: | CEWHNBGJGPXFED-UHFFFAOYSA-N |
LogP: | 0.57660 |
Publication Number | Title | Priority Date |
WO-2018128826-A1 | Compositions and methods for the treatment of bacterial infections | 20170106 |
AU-2017290238-A1 | Diprovocims: a new and potent class of tlr agonists | 20160629 |
CA-3026178-A1 | Diprovocims: a new and potent class of tlr agonists | 20160629 |
EP-3445758-A1 | Diprovocims: a new and potent class of tlr agonists | 20160629 |
JP-2019519574-A | Diprovosim: A new and powerful class of TLR agonists | 20160629 |
Complexity: | 350 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 2 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 259.10558726 |
Formal Charge: | 0 |
Heavy Atom Count: | 18 |
Hydrogen Bond Acceptor Count: | 6 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 259.10558726 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 104 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | -0.1 |
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