N-(Dichlormethylen)anilin

phenyliminophosgene · n-phenylimidophosgene · phenylcarbylaminechloride · Isocyanophenyl dichloride · n-dichloromethylene-anilin · phenylisonitriledichloride · n-phenylcarbimidedichloride · phenyl-imidocarbonylchlorid

https://huagongshe.com/de/chemical/12145

Molekülstruktur von N-(Dichlormethylen)anilin

Identifikatoren & physikalische Daten

CAS No.	622-44-6
Summenformel	C7H5Cl2N
Durchschnittliche Molmasse	174,02 g/mol
Monoisotopische Masse	172,97990452 g/mol
SMILES	ClC(Cl)=Nc1ccccc1
InChIKey	TTWWZVGVBRPHLE-UHFFFAOYSA-N
PubChem CID	12145
EC No.	210-735-0
DTXSID	DTXSID6074833
Lokaler Name	N-(Dichlormethylen)anilin

Chemische & physikalische Eigenschaften

XLogP	3,8
Polarare Oberfläche (TPSA)	12,4
H-Brücken-Donoren	0
H-Brücken-Akzeptoren	1
Frei drehbare Bindungen	1
Schwere Atome	10
Formalladung	0
Komplexität	124
Stoffklassen	Toxic Gases & Vapors -> Acid HalidesFlammable agents - 2nd degree
SpringerMaterials Properties	Boiling point
LogP (Verteilungskoeffizient)	2.54
Geruch	ONION-LIKE ODOR
Dichte	1.285 @ 15 °C1,26 g/cm3
Color/Form	PALE-YELLOW, OILY LIQUID
Löslichkeit	SOL IN BENZENE, ALC, ETHERINSOL IN WATER
Siedepunkt	210 °C @ 760 MM HG103-106°C 30mm
Decomposition	DANGEROUSWHEN HEATED TO DECOMP, IT EMITS HIGHLY TOXIC FUMES OF /HYDROGEN CHLORIDE/.
Schmelzpunkt	19.5 °C19.5°C
Dampfdichte	6.03 (AIR= 1)
Dampfdruck	0.17 [mmHg]
Brechungsindex	n20/D 1.571(lit.)
Flammpunkt	79°C
Lagerbedingungen	2-8°C
pKa (Säurekonstante)	-1.12±0.50(Predicted)
Stabilität	Stable. Incompatible with strong oxidizing agents.
EPA chemische Informationen	Phenylcarbylamine chloride (622-44-6)

Sicherheit & Vorschriften

GHS-Einstufung	DangerH302 (97.6%): Harmful if swallowed [Warning Acute toxicity, oral]P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P316, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 41 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazards Identification	Toxic/poison by inhalation (TIH/PIH)
Regulatorische Informationen	The New Jersey Worker and Community Right to Know Act requires public and private employers to provide information about hazardous substances at their workplaces. (N.J.S.A. 34:5A-1 et. seq.)
DOT-Kennzeichnung	Poison Inhalation Hazard
Brandgefahren	Excerpt from ERG Guide 151 [Substances - Toxic (Non-Combustible)]:· Non-combustible, substance itself does not burn but may decompose upon heating to produce corrosive and/or toxic fumes.
Gesundheitsgefahren	Excerpt from ERG Guide 151 [Substances - Toxic (Non-Combustible)]:· Highly toxic, may be fatal if inhaled, ingested or absorbed through skin.
Gefahrenübersicht	Potent lachrymator[HSDB] Strong irritant that is toxic by inhalation and skin absorption[Hawley] Harmful if ingested or inhaledA skin, eye, and respiratory tract irritant[MSDSonline]
DOT-Nummer und Handbuch	1672 151
Reaktive Gruppe	Halogenated Organic Compounds
Reactivity Profile	PHENYLCARBYLAMINE CHLORIDE may be incompatible with water, strong oxidizing agents, alcohols. Sealed containers held at room temperature may explode, due to slow decomposition that builds up pressure. This situation is more dangerous with heat. May react vigorously or explosively with diisopropyl ether or other ethers in the presence of trace amounts of metal salts [J. Haz. Mat., 1981, 4, 291].