| CAS Number | 1311315-97-5 |
| Catalog Number | AG01AH9M(AGN-PC-0WO9R6) |
| Chemical Name | tert-Butyl N-[2-(methylamino)propyl]carbamate |
| IUPAC Name | tert-butyl N-[2-(methylamino)propyl]carbamate |
| InChI | InChI=1S/C9H20N2O2/c1-7(10-5)6-11-8(12)13-9(2,3)4/h7,10H,6H2,1-5H3,(H,11,12) |
| InChI Key | FIOWXOCWQZXDSB-UHFFFAOYSA-N |
| MDL Number | MFCD18483254 |
| Molecular Formula | C9H20N2O2 |
| Molecular Weight | 188.2673 |
| SMILES | CC(NC)CNC(OC(C)(C)C)=O |
| Synonyms | tert-butyl N-[2-(methylamino)propyl]carbamate,
1311315-97-5,
tert-Butyl (2-(methylamino)propyl)carbamate,
SCHEMBL9600202,
AKOS006283529,
MCULE-6767923615,
NE16335,
EN300-74117,
Z1262448079,
(R)-tert-Butyl (2-(methylamino)propyl)carbamate,
(S)-tert-Butyl (2-(methylamino)propyl)carbamate,
454709-95-6,
454709-96-7,
|
| Complexity | 164 |
| 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 | 5 |
| Topological Polar Surface Area | 50.4A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.9 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number