N-Ethyl-m-toluidin

N-ETHYL-M-TOLUIDINE · N-Ethyl-meta-toluidine · 3-METHYL-N-ETHYLANILINE · N-Ethyltoluidine · n-ethyl-m-toluidin · N-ETHYL-3-TOLUIDINE · 3-ETHYLAMINOTOLUENE · 3(ethylamino)-toluen

https://huagongshe.com/de/chemical/7603

Identifikatoren & physikalische Daten

CAS No.	102-27-2
Summenformel	C9H13N
Durchschnittliche Molmasse	135,21 g/mol
Monoisotopische Masse	135,10479942 g/mol
SMILES	CCNc1cccc(C)c1
InChIKey	GUYMMHOQXYZMJQ-UHFFFAOYSA-N
PubChem CID	7603
ChEMBL	CHEMBL3182610
EC No.	203-019-4
DTXSID	DTXSID4021848
Lokaler Name	N-Ethyl-m-toluidin

Chemische & physikalische Eigenschaften

XLogP	3
Polarare Oberfläche (TPSA)	12
H-Brücken-Donoren	1
H-Brücken-Akzeptoren	1
Frei drehbare Bindungen	2
Schwere Atome	10
Formalladung	0
Komplexität	90,7
Stoffklassen	Nitrogen Compounds -> Amines, Aromatic
SpringerMaterials Properties	Optical coefficient
Color/Form	Light-amber liquidYellow liquid
Löslichkeit	Sol in ethanol and ethyl ethersoluble in Alcohol,Ether1131 mg/L (20 ºC)
Siedepunkt	221 °C221 °C (lit.)
Dampfdruck	0.13 [mmHg]10.9-106Pa at 20-50℃
Brechungsindex	Index of refraction: 1.5451 @ 20 °C/Dn20/D 1.546(lit.)
Physical Description	N-ethyl-m-toluidine appears as a light amber liquid. Less dense than water and insoluble in water. Vapors heavier than air. Produces toxic oxides of nitrogen during combustion. Used to make other chemicals.Light amber or yellow liquid[HSDB] Clear brownish-yellow liquid[MSDSonline]
Schmelzpunkt	-6.87°C (estimate)
Dichte	0.957 g/mL at 25 °C (lit.)
Flammpunkt	89 °C
Aggregatzustand	clear liquid
pKa (Säurekonstante)	5.27±0.25(Predicted)
Farbe	Colorless to Red to Green
BRN	742170
Henry-Konstante	1.6×100 mol/(m3Pa) at 25℃, HSDB (2015)
InChI	1S/C9H13N/c1-3-10-9-6-4-5-8(2)7-9/h4-7,10H,3H2,1-2H3
InChIKey	GUYMMHOQXYZMJQ-UHFFFAOYSA-N
SMILES	CCNc1cccc(C)c1
CAS Datenbank	102-27-2(CAS DataBase Reference)
NIST chemische Informationen	Benzenamine, N-ethyl-3-methyl-(102-27-2)
EPA chemische Informationen	N-Ethyl-m-toluidine (102-27-2)

Sicherheit & Vorschriften

GHS-Einstufung	DangerH301+H311+H331 (43.7%): Toxic if swallowed, in contact with skin or if inhaled [Danger Acute toxicity, oralacute toxicity, dermalacute toxicity, inhalation]P261, P262, P264, P264+P265, P270, P271, P280, P301+P316, P302+P352, P304+P340, P305+P351+P338, P316, P319, P321, P330, P332+P317, P337+P317, P361+P364, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 87 reports by companies from 11 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.H227: Combustible liquid [Warning Flammable liquids]
Regulatorische Informationen	Status: Active Update: 17-01-2019 https://echa.europa.eu/registration-dossier/-/registered-dossier/24872
DOT-Kennzeichnung	Poison
Brandgefahren	Excerpt from ERG Guide 153 [Substances - Toxic and/or Corrosive (Combustible)]:
Gesundheitsgefahren	Excerpt from ERG Guide 153 [Substances - Toxic and/or Corrosive (Combustible)]:
Gefahrenübersicht	Emergency treatment: Aniline[HSDB] Mildly irritating to rabbit skin and eyesNot sensitizing to rabbit skinMethemoglobinemia and hemolytic anemia observed in 2-week inhalation study of ratsSome evidence of mutagenicity[EPA HPVIS] An irritantToxic by ingestion, inhalation, or skin absorption[Aldrich MSDS] See Aniline.
Reaktive Gruppe	Amines, Aromatic
Reactivity Profile	N-ETHYL-M-TOLUIDINE neutralizes acids in exothermic reactions to form salts plus water. May be incompatible with isocyanates, halogenated organics, peroxides, phenols (acidic), epoxides, anhydrides, and acid halides. Flammable gaseous hydrogen may be generated in combination with strong reducing agents, such as hydrides.
DOT Emergency Guidelines	/GUIDE 153: SUBSTANCES - TOXIC AND/OR CORROSIVE (COMBUSTIBLE)/ Health: TOXIC

Anwendungen & Verwendung

Verwenden

Chemical intermediate.