| CAS Number | 1210688-96-2 |
| Catalog Number | AG019XD6 |
| Chemical Name | 2-Methylpentan-3-amine hydrochloride |
| IUPAC Name | 2-methylpentan-3-amine;hydrochloride |
| InChI | InChI=1S/C6H15N.ClH/c1-4-6(7)5(2)3;/h5-6H,4,7H2,1-3H3;1H |
| InChI Key | XELJVUCNNBUHJE-UHFFFAOYSA-N |
| MDL Number | MFCD13196114 |
| Molecular Formula | C6H16ClN |
| Molecular Weight | 137.6509 |
| SMILES | Cl.CCC(C(C)C)N |
| Synonyms | 2-methylpentan-3-amine hydrochloride,
1210688-96-2,
196929-99-4,
(3R)-2-methylpentan-3-amine hydrochloride,
(S)-1-Ethyl-2-methylpropylamine HCl,
AC1Q39MW,
SCHEMBL6261037,
CTK6C7704,
AKOS016906683,
MCULE-4491326477,
NE15733,
EN300-54700,
Z823287438,
196930-00-4,
|
| Complexity | 41.4 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 137.097g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 8 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 137.651g/mol |
| Monoisotopic Mass | 137.097g/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