| CAS Number | 1170512-40-9 |
| Catalog Number | AG019NB3 |
| Chemical Name | [4-(phenoxymethyl)phenyl]methanamine hydrochloride |
| IUPAC Name | [4-(phenoxymethyl)phenyl]methanamine;hydrochloride |
| InChI | InChI=1S/C14H15NO.ClH/c15-10-12-6-8-13(9-7-12)11-16-14-4-2-1-3-5-14;/h1-9H,10-11,15H2;1H |
| InChI Key | NWXSUEBLSCEPSR-UHFFFAOYSA-N |
| MDL Number | MFCD11505528 |
| Molecular Formula | C14H16ClNO |
| Molecular Weight | 249.7359 |
| SMILES | Cl.NCC1=CC=C(COC2=CC=CC=C2)C=C1 |
| Synonyms | [4-(phenoxymethyl)phenyl]methanamine hydrochloride,
1-[4-(phenoxymethyl)phenyl]methanamine hydrochloride,
1170512-40-9,
AC1Q3D7K,
CTK7E4500,
MFCD11505528,
AKOS016901047,
MCULE-9127611633,
NE35365,
4-(Phenoxymethyl)benzylamine hydrochloride,
EN300-39879,
Z415636550,
|
| Complexity | 181 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 249.092g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 249.738g/mol |
| Monoisotopic Mass | 249.092g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 35.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number