| CAS Number | 736173-19-6 |
| Catalog Number | AG005C4Y(AGN-PC-01A9A2) |
| Chemical Name | 2-(Amino-p-tolyl-methyl)-naphthalen-1-ol hydrochloride |
| IUPAC Name | 2-[amino-(4-methylphenyl)methyl]naphthalen-1-ol;hydrochloride |
| InChI | InChI=1S/C18H17NO.ClH/c1-12-6-8-14(9-7-12)17(19)16-11-10-13-4-2-3-5-15(13)18(16)20;/h2-11,17,20H,19H2,1H3;1H |
| InChI Key | BHZWVMQXKHALIB-UHFFFAOYSA-N |
| MDL Number | MFCD07366603 |
| Molecular Formula | C18H18ClNO |
| Molecular Weight | 299.7946 |
| SMILES | Cc1ccc(cc1)C(c1ccc2c(c1O)cccc2)N.Cl |
| Synonyms | 2-(Amino-p-tolyl-methyl)-naphthalen-1-ol hydrochloride,
736173-19-6,
CTK8E3412,
DTXSID90588741,
MFCD07366603,
AB30993,
OR307615,
RT-007172,
T6647,
2-[Amino(4-methylphenyl)methyl]naphthalen-1-ol--hydrogen chloride (1/1),
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| Complexity | 311 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 299.108g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 21 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 299.798g/mol |
| Monoisotopic Mass | 299.108g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 46.2A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
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