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Product Name: Quinazoline, 4-(2-(1,1'-biphenyl)-4-ylethoxy)- (CAS NO.124428-11-1)
Molecular Formula: C22H18N2O
Molecular Weight: 326.42g/mol
Mol File: 124428-11-1.mol
Boiling point: 531.7 °C at 760 mmHg
Flash Point: 187.3 °C
Density: 1.18 g/cm3
Surface Tension: 51.6 dyne/cm
Enthalpy of Vaporization: 77.69 kJ/mol
Vapour Pressure: 7.5E-11 mmHg at 25°C
XLogP3-AA: 5.7
H-Bond Donor: 0
H-Bond Acceptor: 3
Structure Descriptors of Quinazoline, 4-(2-(1,1'-biphenyl)-4-ylethoxy)- (CAS NO.124428-11-1):
IUPAC Name: 4-[2-(4-Phenylphenyl)ethoxy]quinazoline
Canonical SMILES: C1=CC=C(C=C1)C2=CC=C(C=C2)CCOC3=NC=NC4=CC=CC=C43
InChI: InChI=1S/C22H18N2O/c1-2-6-18(7-3-1)19-12-10-17(11-13-19)14-15-25-22-20-8-4-5-9-21(20)23-16-24-22/h1-13,16H,14-15H2
InChIKey: XXRCKOLZQMKPAR-UHFFFAOYSA-N
Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
---|---|---|---|---|---|
mouse | LD50 | oral | > 500mg/kg (500mg/kg) | BEHAVIORAL: MUSCLE WEAKNESS | National Technical Information Service. Vol. OTS0544206, |
quail | LDLo | oral | 500mg/kg (500mg/kg) | BEHAVIORAL: ATAXIA GASTROINTESTINAL: "HYPERMOTILITY, DIARRHEA" | National Technical Information Service. Vol. OTS0545136, |
rat | LD50 | oral | 1150mg/kg (1150mg/kg) | BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY) BEHAVIORAL: ATAXIA GASTROINTESTINAL: "HYPERMOTILITY, DIARRHEA" | National Technical Information Service. Vol. OTS0544207, |
Moderately toxic by ingestion. Experimental reproductive effects. When heated to decomposition it emits toxic vapors of NOx.