N-(2-Chloroethyl)dibenzylamine

N,N-Dibenzyl-2-chloroethan-1-amine · SKF 199 · Dibenamine · (2-Chloroethyl)dibenzylamine · N,N-dibenzyl-2-chloroethanamine · bis(benzyl)-(2-chloroethyl)amine · 2-chloro-N,N-bis(phenylmethyl)ethanamine · Benzenemethanamine, N-(2-chloroethyl)-N-(phenylmethyl)-

https://huagongshe.com/de/chemical/5820

Molekülstruktur von N-(2-Chloroethyl)dibenzylamine

Identifikatoren & physikalische Daten

CAS No.	51-50-3
Summenformel	C16H18ClN
Durchschnittliche Molmasse	259,77 g/mol
Monoisotopische Masse	259,11277726 g/mol
SMILES	ClCCN(Cc1ccccc1)Cc1ccccc1
InChIKey	GSLWSSUWNCJILM-UHFFFAOYSA-N
PubChem CID	5820
ChEMBL	CHEMBL3305685
DTXSID	DTXSID20199001

Chemische & physikalische Eigenschaften

XLogP	3,8
Polarare Oberfläche (TPSA)	3,2
H-Brücken-Donoren	0
H-Brücken-Akzeptoren	1
Frei drehbare Bindungen	6
Schwere Atome	18
Formalladung	0
Komplexität	187
Color/Form	OILY LIQUID
Stability/Shelf Life	TURNS YELLOW ON STORAGE & DECOMP ON STANDING TO FORM SOLID POLYMERIC COMPD /CHLOROETHYLAMINES/STABLE IN ACID SOLN BUT RAPIDLY LOSES ACTIVITY IN NEUTRAL OR ALKALINE AQ SOLUTIONS /HYDROCHLORIDE/
Other Experimental Properties	MP: 192 °C, ALSO GIVEN AS 180-181 °CPRACTICALLY INSOL IN H2O NEAR NEUTRALITYSOLUBLE IN DIL ACID: 2% @ PH 2.1, 1% @ PH 2.4, 0.5% @ PH 2.74SOL IN 95% ALCOHOL, PROPYLENE GLYCOL /HYDROCHLORIDE/COLORLESS CRYSTALLINE SOLID /CHLOROETHYLAMINE HYDROCHLORIDE/
Schmelzpunkt	192 °C
Siedepunkt	407.11°C (rough estimate)
Dichte	1.0738 (rough estimate)
Brechungsindex	1.6000 (estimate)
pKa (Säurekonstante)	6.50±0.50(Predicted)

Sicherheit & Vorschriften

Wechselwirkungen	...ATROPINE APPEARS TO ANTAGONIZE ACTION OF DIBENAMINE OR "DEBLOCK".REDN IN PRESSOR RESPONSE WITHOUT REVERSAL IS USUALLY SEEN WHEN CAPACITY FOR ADRENERGIC VASODILATATION IS LIMITED BY ANY FACTOR, FOR EXAMPLE, SYMPATHOMIMETIC AMINE USED (NOREPINEPHRINE, PHENYLEPHRINE, OR OTHER AGENTS WITH MINIMAL BETA-ADRENERGIC AGONISTIC ACTIVITY) OF PREPN EMPLOYED...FORMATION OF 7% FORMALADHYDE INDUCED SC GRANULOMA WAS GREATLY SUPPRESSED BY EPINEPHRINE & SLIGHTLY BY NOREPINEPHRINE. DIBENAMINE WAS A WEAKER EXPTL GRANULOMA SUPPRESSOR.CENTRAL EFFECTS OF SOME ADRENOLYTICS ON SPONTANEOUS MOTILITY & ON POTENTIATION OF SUBHYPNOTIC DOSES OF SODIUM PENTOBARBITAL WERE STUDIED IN MICE. DIBENAMINE POTENTIATED THE ACTION OF SODIUM PENTOBARBITAL. ALL DRUGS, EXCEPT BRETYLIUM DECR SPONTANEOUS MOTILITY.For more Interactions (Complete) data for DIBENAMINE (9 total), please visit the HSDB record page.
Human Toxicity Excerpts	DIBENAMINE.../STIMULATES/ CNS TO CAUSE NAUSEA, VOMITING, HYPERVENTILATION, MOTOR EXCITABILITY...CONVULSIONS, PARTICULARLY WHEN RELATIVELY LARGE DOSE IS RAPIDLY INJECTED IV. IN MAN, CHARACTERISTIC LOSS OF TIME PERCEPTION MAY OCCUR.LOSS OF VASOMOTOR CONTROL CAN RESULT IN POSTURAL HYPOTENSION & REFLEX TACHYCARDIA IN AMBULATORY PATIENTS, OR A SHARP FALL IN BLOOD PRESSURE IN THOSE WHO ARE HYPOVOLEMIC. /ALPHA-ADRENERGIC BLOCKING AGENTS/OTHER RESULTS OF ALPHA-RECEPTOR BLOCKADE INCL MIOSIS, NASAL STUFFINESS, & INHIBITION OF EJACULATION. /ALPHA-ADRENERGIC BLOCKING AGENTS/
Non-Human Toxicity Excerpts	...TACHYCARDIA IN INTACT ANIMALS IS USUALLY EXAGGERATED BECAUSE PRESSOR RESPONSE IS PREVENTED & REFLEX VAGAL STIMULATION IS MINIMIZED. ...DIBENAMINE INDUCE/S/ REFLEX TACHYCARDIA...BOVINE BRAIN SODIUM-POTASSIUM ACTIVATED ATPASE WAS IRREVERSIBLY INHIBITED BY DIBENAMINE & DIBENAMINE ANALOGS WHICH ARE ADRENERGIC ALPHA-BLOCKERS.
Gefahrstoffdaten	51-50-3(Hazardous Substances Data)