| CAS Number | 55984-59-3 |
| Catalog Number | AG01DGK7 |
| Chemical Name | N-Methylbut-3-en-1-amine hydrochloride |
| IUPAC Name | N-methylbut-3-en-1-amine;hydrochloride |
| InChI | InChI=1S/C5H11N.ClH/c1-3-4-5-6-2;/h3,6H,1,4-5H2,2H3;1H |
| InChI Key | BPSLUDUIYPKSDW-UHFFFAOYSA-N |
| MDL Number | MFCD29905594 |
| Molecular Formula | C5H12ClN |
| Molecular Weight | 121.6085 |
| SMILES | Cl.CNCCC=C |
| Synonyms | N-Methylbut-3-en-1-amine hydrochloride,
55984-59-3,
MFCD29905594,
AX8318762,
|
| Complexity | 32.9 |
| 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 | 3 |
| Topological Polar Surface Area | 12A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
Lot Number