Grundinformationen
- Standard-SMILES
CN(C)c1ccc(N)cc1.Cl- InChIKey
KTWNIUBGGFBRKH-UHFFFAOYSA-N- Summenformel
- C8H13ClN2
- Durchschnittliche Molmasse
- 172,65 g/mol
- Monoisotopische Masse
- 172,0767261
Namen und Bezeichner
- Bevorzugter Name
- 1,4-Benzenediamine, N1,N1-dimethyl-, hydrochloride (1:1)
- IUPAC
- 4-N,4-N-dimethylbenzene-1,4-diamine;hydrochloride
- Lokaler Name
- N,N-Dimethylbenzol-1,4-diaminhydrochlorid
- Englischer Name
- N,N-Dimethyl-p-phenylenediamine monohydrochloride
- Summenformel
- C8H13ClN2
- Molmasse
- 172.66
Namen und Synonyme
2052-46-21,4-Benzenediamine, N1,N1-dimethyl-, hydrochloride (1:1)RefChem:1053152218-146-0N,N-Dimethyl-p-phenylenediamine monohydrochlorideN1,N1-Dimethylbenzene-1,4-diamine hydrochloride13806-04-71,4-Benzenediamine, N,N-dimethyl-, monohydrochloride4-Amino-N,N-dimethylaniline hydrochloride4-Dimethylamineaniline, HClN,N-Dimethyl-p-phenylenediamine hydrochloride4-Amino-N,N-dimethylaniline monohydrochloride
Weitere Namen anzeigen
N,N-DIMETHYL-P-PHENYLENEDIAMINE MONON1,N1-dimethylbenzene-1,4-diamine HClN,N-Dimethyl-1,4-Phenylene Diamine HCLP-AMINODIMETHYLANILINE MONOHYDROCHLORIDEN,N-DIMETHYL-P-PHENYLENEDIAMINE HCL (MONO)P-[DIMETHYLAMINO]ANILINE MONOHYDROCHLORIDE4-(dimethylamino)aniline monohydrochloridep-Amino-N.N-dimethylanilinehydrochloride
MFCD00012990N,N-Dimethylbenzene-1,4-diamine hydrochloridep-Amino-N,N-dimethylaniline monohydrochloride4-N,4-N-dimethylbenzene-1,4-diamine;hydrochloride1,4-Benzenediamine, N,N-dimethyl-, hydrochloride4-Dimethylamineaniline hydrochloriden,n-dimethyl-1,4-phenylenediamine monohydrochlorideNSC-47696
Datenbank-Bezeichner
- CAS
13806-04-7、2052-46-2、536-46-9- PubChem CID
- 7736
- DTXSID
DTXSID50883789- UNII
- LPL8QUW2RC
- EC Number
- 218-146-0、237-455-1
Eigenschaften
Berechnete Struktureigenschaften
- Polarare Oberfläche (TPSA)
- 29,3 Ų
- H-Brücken-Donoren
- 2
- H-Brücken-Akzeptoren
- 2
- Frei drehbare Bindungen
- 1
- Schwere Atome
- 11
- Formalladung
- 0
- Komplexität
- 93,4
Experimentelle und physikochemische Eigenschaften
Chemical ClassesNitrogen Compounds -> Amines, Aromatic
Physical DescriptionGrey crystalline solid; Hygroscopic; [Sigma-Aldrich MSDS]
Physikochemische Eigenschaften
- Schmelzpunkt
- 215 °C · 215 °C (dec.)(lit.)
- storage temp.
- -20 °C · -20°C
- Löslichkeit
- DMSO (Slightly), Methanol (Slightly, Sonicated)
- Aggregatzustand
- Solid
- Farbe
- Grey to Black
- BRN
- 4546912 · 4546912
- Stabilität
- Hygroscopic
- InChI
- 1S/C8H12N2.ClH/c1-10(2)8-5-3-7(9)4-6-8;/h3-6H,9H2,1-2H3;1H
- InChIKey
- KTWNIUBGGFBRKH-UHFFFAOYSA-N
- SMILES
- Cl[H].CN(C)c1ccc(N)cc1
- CAS Datenbank
- 2052 · 2052-46-2(CAS DataBase Reference)
- EPA chemische Informationen
- 1 · 1,4-Benzenediamine, N,N-dimethyl-, monohydrochloride (2052-46-2)
Sicherheit und Regulatorisches
GHS-Klassifizierung
GHS Classification
This chemical does not meet GHS hazard criteria for 2.4% (1 of 41) of reports.
Danger
H300 (97.6%): Fatal if swallowed [Danger Acute toxicity, oral]
P233, P260, P261, P262, P264, P270, P271, P280, P284, P301+P316, P302+P352, P304+P340, P316, P321, P330, P342+P316, P361+P364, P403, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 41 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Gefahrenhinweise
Hazards Summary
Causes tremor, convulsions, and somnolence oral lethal-dose studies of rodents; [RTECS] May cause irritation and respiratory sensitization; May induce methemoglobinemia; Highly toxic by ingestion and inhalation; Toxic by skin absorption; [Sigma-Aldrich MSDS] See N,N-Dimethyl-p-benzenediamine.
Hazard Classes and CategoriesAcute Tox. 2 (97.6%)
Toxikologische Informationen
Adverse EffectsNeurotoxin - Other CNS neurotoxin
Sicherheitsdaten
- F
- 3-8-10
- wgk
- 3
- tsca
- TSCA listed
- ridadr
- UN 2811 6.1/PG 2
- hs_code
- 2921490090
- RTECS-Nr.
- ST1750000
- risk_code
- 23/24/25-43
- hazard_code
- T
- safety_code
- 36/37-45
- hazard_class
- 6.1(a)
- packing_group
- II
- Speicherklasse
- 6.1A - Combustible acute toxic Cat. 1 and 2very toxic hazardous materials
- Hazard Classifications
- Acute Tox. 2 OralAcute Tox. 3 DermalAcute Tox. 3 InhalationResp. Sens. 1
Chemie und Industrie
Verwendung und Herstellung
General Manufacturing Information
1,4-Benzenediamine, N1,N1-dimethyl-, hydrochloride (1:1): ACTIVE
1,4-Benzenediamine, N1,N1-dimethyl-, hydrochloride (1:?): INACTIVE
Anwendungen
Verwenden4-Dimethylamineaniline, HCl. Dyes and metabolites. 4-Dimethylamineaniline Hydrochloride can be used to treat tauopathies.
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