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Catalog Number | ACM2196603 |
CAS Number | 2196-60-3 |
Structure | ![]() |
Synonyms | (R)-1,2,3,4-Tetrahydro-1-(4-hydroxybenzyl)-6-methoxyisoquinolin-7-ol |
Molecular Weight | 285.34 |
InChI | InChI=1S/C17H19NO3/c1-21-17-9-12-6-7-18-15(14(12)10-16(17)20)8-11-2-4-13(19)5-3-11/h2-5,9-10,15,18-20H,6-8H2,1H3/t15-/m1/s1 |
InChI Key | LVVKXRQZSRUVPY-OAHLLOKOSA-N |
Melting Point | 222-224 °C |
Purity | 95%+ |
Complexity | 330 |
Covalently-Bonded Unit Count | 1 |
Defined Atom Stereocenter Count | 1 |
Exact Mass | 285.13649347 |
Heavy Atom Count | 21 |
Hydrogen Bond Acceptor Count | 4 |
Hydrogen Bond Donor Count | 3 |
Isomeric SMILES | COC1=C(C=C2[C@H](NCCC2=C1)CC3=CC=C(C=C3)O)O |
Monoisotopic Mass | 285.13649347 |
PhysicalState | Powder |
Rotatable Bond Count | 3 |
Topological Polar Surface Area | 61.7 Ų |
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