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Demethyl · CAS 11041-94-4 · C16H18ClNO3. UNII PQ432PID6E.
| CAS Registry Number | 11041-94-4 |
|---|---|
| PubChem CID | 165901 |
| Molecular formula | C16H18ClNO3 |
| IUPAC name | 1-[(4-hydroxyphenyl)methyl]-1,2,3,4-tetrahydroisoquinoline-6,7-diol;hydrochloride |
| UNII (FDA) | PQ432PID6E |
| Molecular Weight | 307.77 |
|---|---|
| Hydrogen Bond Donor Count | 5 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 2 |
| Exact Mass | 307.0975211 |
| Monoisotopic Mass | 307.0975211 |
| Topological Polar Surface Area | 72.7 |
| Heavy Atom Count | 21 |
| Formal Charge | 0 |
| Complexity | 317 |
| Reported hazard statements | H302 (100%), H319 (100%), H410 (97.4%) |
|---|
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
Higenamine hydrochloride; 11041-94-4; PQ432PID6E; (+-)-Demethylcoclaurine hydrochloride; 1-[(4-hydroxyphenyl)methyl]-1,2,3,4-tetrahydroisoquinoline-6,7-diol hydrochloride; (+-)-1,2,3,4-Tetrahydro-1-((4-hydroxyphenyl)methyl)-6,7-isoquinolinediol hydrochloride; 6,7-Isoquinolinediol, 1,2,3,4-tetrahydro-1-((4-hydroxyphenyl)methyl)-, hydrochloride, (+-)-; 6,7-Isoquinolinediol, 1,2,3,4-tetrahydro-1-[(4-hydroxyphenyl)methyl]-, hydrochloride (1:1); 6,7-ISOQUINOLINEDIOL, 1,2,3,4-TETRAHYDRO-1-((4-HYDROXYPHENYL)METHYL)-, HYDROCHLORIDE (1:1); 1-((4-hydroxyphenyl)methyl)-1,2,3,4-tetrahydroisoquinoline-6,7-diol hydrochloride; RefChem:788356; DEMETHYLCOCLAURINE HYDROCHLORIDE, (+-)-; 802-566-1; Higenamine HCl; Demethyl; 6,7-dihydroxy-1-(4-hydroxybenzyl)-1,2,3,4-tetrahydroisoquinoline hydrochloride
CAS 11041-94-4; molecular formula C16H18ClNO3; molecular weight — g/mol.
Higenamine hydrochloride, 11041-94-4, PQ432PID6E, (+-)-Demethylcoclaurine hydrochloride, 1-[(4-hydroxyphenyl)methyl]-1,2,3,4-tetrahydroisoquinoline-6,7-diol hydrochloride, (+-)-1,2,3,4-Tetrahydro-1-((4-hydroxyphenyl)methyl)-6,7-isoquinolinediol hydrochloride.
Hazard statements reported: H302, H319, H410.
Facts on this page are taken from PubChem (US National Library of Medicine) and Wikidata. Grade-specific data — assay, moisture, particle size, packaging, shelf life — is issued per batch on the COA and is not published here.