Molecule structure of Aminoindanol hydrochloride (CAS NO.13935-78-9) :
IUPAC Name: 2-amino-2,3-dihydro-1H-inden-1-ol hydrochloride
Molecular Weight: 185.65068 g/mol
Molecular Formula: C9H12ClNO
Boiling Point: 296.9 °C at 760 mmHg
Flash Point: 133.4 °C
Enthalpy of Vaporization: 56.68 kJ/mol
Vapour Pressure: 0.000626 mmHg at 25 °C
H-Bond Donor: 3
H-Bond Acceptor: 2
Exact Mass: 185.060742
MonoIsotopic Mass: 185.060742
Topological Polar Surface Area: 46.3
Heavy Atom Count: 12
Complexity: 149
Canonical SMILES: C1C(C(C2=CC=CC=C21)O)N.Cl
InChI: InChI=1S/C9H11NO.ClH/c10-8-5-6-3-1-2-4-7(6)9(8)11;/h1-4,8-9,11H,5,10H2;1H
InChIKey: KNFDUVWKQCDJQM-UHFFFAOYSA-N
1. | scu-rat LD50:350 mg/kg | AEPPAE Naunyn-Schmiedeberg’s Archiv fuer Experimentelle Pathologie und Pharmakologie. 169 (1933),114. | ||
2. | scu-mus LD50:800 mg/kg | AEPPAE Naunyn-Schmiedeberg’s Archiv fuer Experimentelle Pathologie und Pharmakologie. 169 (1933),114. | ||
3. | scu-gpg LD50:400 mg/kg | AEPPAE Naunyn-Schmiedeberg’s Archiv fuer Experimentelle Pathologie und Pharmakologie. 169 (1933),114. |
Poison by subcutaneous route. When heated to decomposition it emits very toxic fumes of NOx and HCl.
Aminoindanol hydrochloride (CAS NO.13935-78-9) is also named 1-Indanol, 2-amino-, hydrochloride ; 2-Amino-1-hydroxyhydrindene hydrochloride .
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