| CAS Number | 1087792-22-0 |
| Catalog Number | AG019MR7(AGN-PC-0WCN2K) |
| Chemical Name | ethyl N-(1-amino-4-methylpentan-2-yl)carbamate |
| IUPAC Name | ethyl N-(1-amino-4-methylpentan-2-yl)carbamate |
| InChI | InChI=1S/C9H20N2O2/c1-4-13-9(12)11-8(6-10)5-7(2)3/h7-8H,4-6,10H2,1-3H3,(H,11,12) |
| InChI Key | DMIHYDRZOKDMEP-UHFFFAOYSA-N |
| MDL Number | MFCD11099482 |
| Molecular Formula | C9H20N2O2 |
| Molecular Weight | 188.2673 |
| SMILES | CCOC(NC(CC(C)C)CN)=O |
| Synonyms | ethyl N-(1-amino-4-methylpentan-2-yl)carbamate,
1087792-22-0,
ethyl 1-(aminomethyl)-3-methylbutylcarbamate,
AC1Q359M,
CTK6F9514,
AKOS009291841,
MCULE-7319006177,
NE14871,
EN300-37029,
F8880-4359,
Z1238477840,
|
| Complexity | 149 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 188.152g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 188.271g/mol |
| Monoisotopic Mass | 188.152g/mol |
| Rotatable Bond Count | 6 |
| Topological Polar Surface Area | 64.4A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number