| CAS Number | 76813-80-4 |
| Catalog Number | AG00ICRM(AGN-PC-0WB6JU) |
| Chemical Name | 2-(Benzyloxy)benzylamine hydrochloride |
| IUPAC Name | (2-phenylmethoxyphenyl)methanamine;hydrochloride |
| InChI | InChI=1S/C14H15NO.ClH/c15-10-13-8-4-5-9-14(13)16-11-12-6-2-1-3-7-12;/h1-9H,10-11,15H2;1H |
| InChI Key | WIBRTIIDPUUXJU-UHFFFAOYSA-N |
| MDL Number | MFCD11520394 |
| Molecular Formula | C14H16ClNO |
| Molecular Weight | 249.7359 |
| SMILES | NCC1=CC=CC=C1OCC2=CC=CC=C2.[H]Cl |
| Synonyms | 76813-80-4,
[2-(benzyloxy)phenyl]methanamine hydrochloride,
(2-(benzyloxy)phenyl)methanamine hydrochloride,
2-benzyloxybenzylamine hydrochloride,
AC1Q3D65,
SCHEMBL6482842,
CTK8F2408,
WIBRTIIDPUUXJU-UHFFFAOYSA-N,
MFCD11520394,
2-Benzyloxy-benzyl amine hydrochloride,
AKOS005063142,
MCULE-5408622676,
NE40825,
[2-(benzyloxy)benzyl]amine hydrochloride,
EN300-43649,
1-[2-(BENZYLOXY)PHENYL]METHANAMINE HYDROCHLORIDE,
Z449368980,
(2-phenylmethoxyphenyl)methanamine;hydrochloride,
156867-62-8,
|
| Complexity | 189 |
| 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
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Certificate of Analysis
Lot Number