| CAS Number | 70267-48-0 |
| Catalog Number | AG01DKLF(AGN-PC-0ACY0R) |
| Chemical Name | pent-1-en-3-amine hydrochloride |
| IUPAC Name | pent-1-en-3-amine;hydrochloride |
| InChI | InChI=1S/C5H11N.ClH/c1-3-5(6)4-2;/h3,5H,1,4,6H2,2H3;1H |
| InChI Key | YDDAXAQQIMSFQC-UHFFFAOYSA-N |
| MDL Number | MFCD22689959 |
| Molecular Formula | C5H12ClN |
| Molecular Weight | 121.6085 |
| NSC Number | 63051 |
| SMILES | Cl.CCC(N)C=C |
| Synonyms | PENT-1-EN-3-AMINE HCL,
Pent-1-en-3-amine hydrochloride,
70267-48-0,
NSC63051,
NSC-63051,
AS-38692,
|
| Complexity | 41.2 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 121.066g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 7 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 121.608g/mol |
| Monoisotopic Mass | 121.066g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 26A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number