Molecular Structure of Hydrazine, p-methoxybenzyl-, hydrochloride (CAS NO.2011-48-5):
IUPAC Name: [(4-Methoxyphenyl)methylamino]azanium chloride
Canonical SMILES: COC1=CC=C(C=C1)CN[NH3+].[Cl-]
InChI: InChI=1S/C8H12N2O.ClH/c1-11-8-4-2-7(3-5-8)6-10-9;/h2-5,10H,6,9H2,1H3;1H
InChIKey: NWIAETGHZKYGAD-UHFFFAOYSA-N
Molecular Weight: 188.65462 [g/mol]
Molecular Formula: C8H13ClN2O
H-Bond Donor: 2
H-Bond Acceptor: 3
Rotatable Bond Count: 3
Exact Mass: 188.071641
MonoIsotopic Mass: 188.071641
Topological Polar Surface Area: 48.9
Heavy Atom Count: 12
Complexity: 100
Flash Point: 142.5 °C
Enthalpy of Vaporization: 55.29 kJ/mol
Boiling Point: 311.9 °C at 760 mmHg
Vapour Pressure: 0.000546 mmHg at 25 °C
Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
---|---|---|---|---|---|
mouse | LD50 | intraperitoneal | 50mg/kg (50mg/kg) | National Technical Information Service. Vol. AD277-689, |
Hydrazine, p-methoxybenzyl-, hydrochloride (CAS NO.2011-48-5), its Synonyms are 4-Methoxybenzylhydrazine hydrochloride ; Hydrazine,[(4-methoxyphenyl)methyl]-, hydrochloride (1:1) ; Hydrazine,(p-methoxybenzyl)-, hydrochloride (7CI) ; Hydrazine, [(4-methoxyphenyl)methyl]-,monohydrochloride (9CI) .
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