| CAS Number | 1156752-69-0 |
| Catalog Number | AG01AA2D(AGN-PC-0WO1R6) |
| Chemical Name | 2-(2,3-Dihydro-1,4-benzodioxin-5-yl)pyrrolidine |
| IUPAC Name | 2-(2,3-dihydro-1,4-benzodioxin-5-yl)pyrrolidine |
| InChI | InChI=1S/C12H15NO2/c1-3-9(10-4-2-6-13-10)12-11(5-1)14-7-8-15-12/h1,3,5,10,13H,2,4,6-8H2 |
| InChI Key | KWCSDLHWGQZNOR-UHFFFAOYSA-N |
| MDL Number | MFCD12090246 |
| Molecular Formula | C12H15NO2 |
| Molecular Weight | 205.2530 |
| SMILES | C1CC(C2=C3C(OCCO3)=CC=C2)NC1 |
| Synonyms | 2-(2,3-dihydro-1,4-benzodioxin-5-yl)pyrrolidine,
1156752-69-0,
AC1Q1I7P,
SCHEMBL16309063,
AKOS009808783,
MCULE-5060273920,
NE24583,
EN300-66842,
Z1222278748,
|
| Complexity | 222 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 205.11g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 205.257g/mol |
| Monoisotopic Mass | 205.11g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 30.5A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.5 |
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Certificate of Analysis
Lot Number