| CAS Number | 1154885-27-4 |
| Catalog Number | AG01BI15 |
| Chemical Name | 4-(aminomethyl)-N-benzyl-N-methyloxan-4-amine |
| IUPAC Name | 4-(aminomethyl)-N-benzyl-N-methyloxan-4-amine |
| InChI | InChI=1S/C14H22N2O/c1-16(11-13-5-3-2-4-6-13)14(12-15)7-9-17-10-8-14/h2-6H,7-12,15H2,1H3 |
| InChI Key | CZZQHEZJEJDJIH-UHFFFAOYSA-N |
| MDL Number | MFCD12087803 |
| Molecular Formula | C14H22N2O |
| Molecular Weight | 234.3373 |
| SMILES | CN(C1(CCOCC1)CN)CC1=CC=CC=C1 |
| Synonyms | 4-(aminomethyl)-N-benzyl-N-methyloxan-4-amine,
1154885-27-4,
SCHEMBL16143350,
ZINC36304833,
|
| 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 | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 234.343g/mol |
| Monoisotopic Mass | 234.173g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 38.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number