| CAS Number | 1269054-76-3 |
| Catalog Number | AG00J133 |
| Chemical Name | 3-[(1-naphthylmethyl)amino]-1-propanol hydrochloride |
| IUPAC Name | 3-(naphthalen-1-ylmethylamino)propan-1-ol;hydrochloride |
| InChI | InChI=1S/C14H17NO.ClH/c16-10-4-9-15-11-13-7-3-6-12-5-1-2-8-14(12)13;/h1-3,5-8,15-16H,4,9-11H2;1H |
| InChI Key | UXNFSYQYUIGYPJ-UHFFFAOYSA-N |
| MDL Number | MFCD13186073 |
| Molecular Formula | C14H18ClNO |
| Molecular Weight | 251.7518 |
| SMILES | C12C=CC=CC1=CC=CC=2CNCCCO.Cl |
| Synonyms | 3-[(1-Naphthylmethyl)amino]-1-propanol hydrochloride,
1269054-76-3,
ZX-CM002778,
MFCD13186073,
MCULE-8332117796,
14131-11-4,
|
| Complexity | 195 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 251.108g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 251.754g/mol |
| Monoisotopic Mass | 251.108g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 32.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
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