| CAS Number | 852879-02-8 |
| Catalog Number | AG01B7M9(AGN-PC-0OJTKV) |
| Chemical Name | Hex-5-en-3-amine hydrochloride |
| IUPAC Name | hex-5-en-3-amine;hydrochloride |
| InChI | InChI=1S/C6H13N.ClH/c1-3-5-6(7)4-2;/h3,6H,1,4-5,7H2,2H3;1H |
| InChI Key | CDVTZJRSOZOAAA-UHFFFAOYSA-N |
| MDL Number | MFCD08451503 |
| Molecular Formula | C6H14ClN |
| Molecular Weight | 135.6351 |
| SMILES | Cl.CCC(CC=C)N |
| Synonyms | hex-5-en-3-amine hydrochloride,
852879-02-8,
AKOS026741685,
Z1981870426,
5-Hexen-3-amine, hydrochloride,
|
| Complexity | 50.1 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 135.081g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 8 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 135.635g/mol |
| Monoisotopic Mass | 135.081g/mol |
| Rotatable Bond Count | 3 |
| 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