(1R,2R)-2-Amino-1-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)-3-(1-pyrrolidinyl)-1-propanol - CAS 491833-28-4
Catalog: |
BB026647 |
Product Name: |
(1R,2R)-2-Amino-1-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)-3-(1-pyrrolidinyl)-1-propanol |
CAS: |
491833-28-4 |
Synonyms: |
(1R,2R)-2-amino-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(1-pyrrolidinyl)-1-propanol; (1R,2R)-2-amino-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-pyrrolidin-1-ylpropan-1-ol |
IUPAC Name: | (1R,2R)-2-amino-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-pyrrolidin-1-ylpropan-1-ol |
Description: | (1R,2R)-2-Amino-1-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)-3-(1-pyrrolidinyl)-1-propanol (CAS# 491833-28-4) is derived from L-Phenylglycinol (P327300), which is a chiral arylalkylamine used as organocatalysts. Also, it is used in the synthesis and chiral recognition properties of novel fluorescent chemosensors for amino acids. |
Molecular Weight: | 278.35 |
Molecular Formula: | C15H22N2O3 |
Canonical SMILES: | C1CCN(C1)CC(C(C2=CC3=C(C=C2)OCCO3)O)N |
InChI: | InChI=1S/C15H22N2O3/c16-12(10-17-5-1-2-6-17)15(18)11-3-4-13-14(9-11)20-8-7-19-13/h3-4,9,12,15,18H,1-2,5-8,10,16H2/t12-,15-/m1/s1 |
InChI Key: | MPRDYMIZJFVAAH-IUODEOHRSA-N |
LogP: | 1.55250 |
Publication Number | Title | Priority Date |
WO-2020194138-A1 | An improved process for the preparation of eliglustat and its intermediate | 20190322 |
CN-110878079-A | Preparation method of high-purity eliagliptat | 20181231 |
WO-2020020365-A1 | Method for preparing optically active eliglustat | 20180727 |
US-2020306225-A1 | Stable n-((1r,2r)-1-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)-1-hydroxy-3-(pyrrolidin-1-yl)propan-2-yl) octanamide (2r,3r)-2,3-dihydroxysuccinate premix and process for preparation thereof | 20171027 |
EP-3611171-A1 | Method for synthesis of eliglustat and intermediate compounds thereof | 20170321 |
Complexity: | 310 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 2 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 278.16304257 |
Formal Charge: | 0 |
Heavy Atom Count: | 20 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 278.16304257 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 68 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.4 |
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