| CAS Number | 953750-99-7 |
| Catalog Number | AG019MHR(AGN-PC-0WO3N4) |
| Chemical Name | 2-(pyrrolidin-1-yl)butan-1-amine |
| IUPAC Name | 2-pyrrolidin-1-ylbutan-1-amine |
| InChI | InChI=1S/C8H18N2/c1-2-8(7-9)10-5-3-4-6-10/h8H,2-7,9H2,1H3 |
| InChI Key | WMFCMIRCRKQLRO-UHFFFAOYSA-N |
| MDL Number | MFCD09728370 |
| Molecular Formula | C8H18N2 |
| Molecular Weight | 142.2419 |
| SMILES | CCC(N1CCCC1)CN |
| Synonyms | 2-(pyrrolidin-1-yl)butan-1-amine,
2-pyrrolidin-1-ylbutan-1-amine,
953750-99-7,
AC1Q2SGS,
SCHEMBL4035791,
CTK6C9008,
AKOS000137421,
AKOS022271897,
MCULE-4109573673,
NE31227,
EN300-36232,
F2186-0281,
Z1238477832,
|
| Complexity | 87.3 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 142.147g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 142.246g/mol |
| Monoisotopic Mass | 142.147g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 29.3A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.8 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number