| CAS Number | 56415-14-6 |
| Catalog Number | AG00EN62(AGN-PC-0WBO1W) |
| Chemical Name | 2-amino-3-methyl-1-(morpholin-4-yl)butan-1-one hydrochloride |
| IUPAC Name | 2-amino-3-methyl-1-morpholin-4-ylbutan-1-one;hydrochloride |
| InChI | InChI=1S/C9H18N2O2.ClH/c1-7(2)8(10)9(12)11-3-5-13-6-4-11;/h7-8H,3-6,10H2,1-2H3;1H |
| InChI Key | DGJTWBDMXQXJKD-UHFFFAOYSA-N |
| MDL Number | MFCD13562067 |
| Molecular Formula | C9H19ClN2O2 |
| Molecular Weight | 222.7124 |
| SMILES | Cl.CC(C(C(N1CCOCC1)=O)N)C |
| Synonyms | 2-Amino-3-methyl-1-(4-morpholinyl)-1-butanone hydrochloride,
56415-14-6,
[2-Methyl-1-(morpholin-4-ylcarbonyl)propyl]amine hydrochloride,
CTK7D4076,
ZX-AV000146,
5705AE,
MFCD13562067,
AKOS015848311,
TR-069127,
2-Amino-3-methyl-1-morpholinobutan-1-one hydrochloride,
2-Amino-3-methyl-1-(4-morpholinyl)-1-butanonehydrochloride,
2-amino-3-methyl-1-(morpholin-4-yl)butan-1-one hydrochloride,
C9H19ClN2O2,
|
| Complexity | 177 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 222.114g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 222.713g/mol |
| Monoisotopic Mass | 222.114g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 55.6A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number