| CAS Number | 1306605-25-3 |
| Catalog Number | AG01AI2M |
| Chemical Name | 4-(aminomethyl)-N-(1-phenylethyl)oxan-4-amine |
| IUPAC Name | 4-(aminomethyl)-N-(1-phenylethyl)oxan-4-amine |
| InChI | InChI=1S/C14H22N2O/c1-12(13-5-3-2-4-6-13)16-14(11-15)7-9-17-10-8-14/h2-6,12,16H,7-11,15H2,1H3 |
| InChI Key | SJSHDLFGAZOKEL-UHFFFAOYSA-N |
| MDL Number | MFCD18838801 |
| Molecular Formula | C14H22N2O |
| Molecular Weight | 234.3373 |
| SMILES | CC(C1=CC=CC=C1)NC1(CCOCC1)CN |
| Synonyms | 4-(aminomethyl)-N-(1-phenylethyl)oxan-4-amine,
1306605-25-3,
AKOS013356207,
MCULE-9086393365,
NE39236,
EN300-76536,
Z1696844438,
|
| Complexity | 220 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 234.173g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 234.343g/mol |
| Monoisotopic Mass | 234.173g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 47.3A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number