| CAS Number | 954577-56-1 |
| Catalog Number | AG01A951(AGN-PC-0WO9KC) |
| Chemical Name | 2-(5-Methylfuran-2-yl)-2-(pyrrolidin-1-yl)ethan-1-amine |
| IUPAC Name | 2-(5-methylfuran-2-yl)-2-pyrrolidin-1-ylethanamine |
| InChI | InChI=1S/C11H18N2O/c1-9-4-5-11(14-9)10(8-12)13-6-2-3-7-13/h4-5,10H,2-3,6-8,12H2,1H3 |
| InChI Key | ZYSRLRPCZLJNIW-UHFFFAOYSA-N |
| MDL Number | MFCD09739899 |
| Molecular Formula | C11H18N2O |
| Molecular Weight | 194.2734 |
| SMILES | CC1OC(C(N2CCCC2)CN)=CC=1 |
| Synonyms | 2-(5-methylfuran-2-yl)-2-(pyrrolidin-1-yl)ethan-1-amine,
954577-56-1,
AC1Q2MNU,
CTK7E2627,
AKOS000147226,
AKOS022477966,
MCULE-5300922889,
NE14370,
EN300-64201,
F2186-0310,
Z228571002,
2-(5-METHYL-2-FURYL)-2-PYRROLIDIN-1-YLETHANAMINE,
|
| Complexity | 180 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 194.142g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 194.278g/mol |
| Monoisotopic Mass | 194.142g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 42.4A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.8 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number