Basic Information | Post buying leads | Suppliers |
Name |
Dichlorimipramine |
EINECS | N/A |
CAS No. | 3589-22-8 | Density | 1.191g/cm3 |
PSA | N/A | LogP | N/A |
Solubility | N/A | Melting Point |
N/A |
Formula | C19H22Cl2N2 | Boiling Point | 464.6°Cat760mmHg |
Molecular Weight | 349.33 | Flash Point | 234.8°C |
Transport Information | N/A | Appearance | N/A |
Safety | A poison by intravenous route. When heated to decomposition it emits toxic vapors of NOx and Cl−. | Risk Codes | N/A |
Molecular Structure | Hazard Symbols | A poison. | |
Synonyms |
N/A |
Molecule structure of Dichlorimipramine (CAS NO.3589-22-8):
IUPAC Name: 3-(2,9-Dichloro-5,6-dihydrobenzo[b][1]benzazepin-11-yl)-N,N-dimethylpropan-1-amine
Molecular Weight: 349.29738 g/mol
Molecular Formula: C19H22Cl2N2
Density: 1.191 g/cm3
Boiling Point: 464.6 °C at 760 mmHg
Flash Point: 234.8 °C
Index of Refraction: 1.588
Molar Refractivity: 98.71 cm3
Molar Volume: 293.1 cm3
Polarizability: 39.13×10-24 cm3
Surface Tension: 43.2 dyne/cm
Enthalpy of Vaporization: 72.6 kJ/mol
Vapour Pressure: 8.26E-09 mmHg at 25 °C
XLogP3: 5.8
H-Bond Acceptor: 2
Rotatable Bond Count: 4
Exact Mass: 348.116004
MonoIsotopic Mass: 348.116004
Topological Polar Surface Area: 6.5
Heavy Atom Count: 23
Complexity: 348
Canonical SMILES: CN(C)CCCN1C2=C(CCC3=C1C=C(C=C3)Cl)C=CC(=C2)Cl
InChI: InChI=1S/C19H22Cl2N2/c1-22(2)10-3-11-23-18-12-16(20)8-6-14(18)4-5-15-7-9-17(21)13-19(15)23/h6-9,12-13H,3-5,10-11H2,1-2H3
InChIKey of Dichlorimipramine (CAS NO.3589-22-8): ZRLHYTJLNUJZLB-UHFFFAOYSA-N
1. | ivn-rat LD50:41 mg/kg | AIPTAK Archives Internationales de Pharmacodynamie et de Therapie. 120 (1959),450. | ||
2. | ivn-mus LD50:42 mg/kg | AIPTAK Archives Internationales de Pharmacodynamie et de Therapie. 120 (1959),450. | ||
3. | ivn-rbt LD50:15 mg/kg | AIPTAK Archives Internationales de Pharmacodynamie et de Therapie. 120 (1959),450. |
A poison by intravenous route. When heated to decomposition it emits toxic vapors of NOx and Cl−.
Dichlorimipramine (CAS NO.3589-22-8) is also named as 5H-Dibenz(b,f)azepine, 10,11-dihydro-3,7-dichloro-5-(3-
(dimethylamino)propyl)- ; 5H-Dibenz(b,f)azepine, 3,7-dichloro-5-(3-(dimethylamino)propyl)-10,11-dihydro- ; G 28364 .