| CAS Number | 1042807-69-1 |
| Catalog Number | AG01A13F(AGN-PC-0WO1Z1) |
| Chemical Name | 2-(3-Methylbutyl)pyrrolidine |
| IUPAC Name | 2-(3-methylbutyl)pyrrolidine |
| InChI | InChI=1S/C9H19N/c1-8(2)5-6-9-4-3-7-10-9/h8-10H,3-7H2,1-2H3 |
| InChI Key | OYHNQRWWFPHQPL-UHFFFAOYSA-N |
| MDL Number | MFCD11170292 |
| Molecular Formula | C9H19N |
| Molecular Weight | 141.2539 |
| SMILES | CC(CCC1NCCC1)C |
| Synonyms | 2-(3-methylbutyl)pyrrolidine,
1042807-69-1,
SCHEMBL12855097,
AKOS009217150,
MCULE-9458088716,
NE24492,
F8880-3219,
Z1442184634,
|
| Complexity | 88.7 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 141.152g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 141.258g/mol |
| Monoisotopic Mass | 141.152g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 12A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.4 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number