Zurück
HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
HCID 122721Erstellt: 23. Oktober 2026

Benzenemethanamine, 3-chloro-N-methyl-

3-Chloro-NN-methylbenzylamine

https://huagongshe.com/de/chemical/122721

Molekülstruktur von Benzenemethanamine, 3-chloro-N-methyl-

Identifikatoren & physikalische Daten

CAS No.39191-07-6
SummenformelC8H10ClN
Durchschnittliche Molmasse155,62 g/mol
Monoisotopische Masse155,050177 g/mol
SMILESCNCc1cccc(Cl)c1
InChIKeyZPNLAQVYPIAHTO-UHFFFAOYSA-N
PubChem CID122721
ChEMBLCHEMBL1178161
EC No.254-343-8
DTXSIDDTXSID4068163

Chemische & physikalische Eigenschaften

XLogP2,2
Polarare Oberfläche (TPSA)12
H-Brücken-Donoren1
H-Brücken-Akzeptoren1
Frei drehbare Bindungen2
Schwere Atome10
Formalladung0
Komplexität95
Siedepunkt97 °C/0.6 mmHg (lit.)
Dichte1.072 g/mL at 25 °C (lit.)
Brechungsindexn20/D 1.5395(lit.)
Flammpunkt115 °F
LagerbedingungenKeep in dark place,Inert atmosphere,Room temperature
pKa (Säurekonstante)9.34±0.10(Predicted)
InChI1S/C8H10ClN/c1-10-6-7-3-2-4-8(9)5-7/h2-5,10H,6H2,1H3
InChIKeyZPNLAQVYPIAHTO-UHFFFAOYSA-N
SMILESCNCc1cccc(Cl)c1
NIST chemische InformationenN-methyl-m-chlorobenzylamine(39191-07-6)
EPA chemische InformationenBenzenemethanamine, 3-chloro-N-methyl- (39191-07-6)

Sicherheit & Vorschriften

GHS-EinstufungDangerH226 (100%): Flammable liquid and vapor [Warning Flammable liquids]H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]H318 (100%): Causes serious eye damage [Danger Serious eye damage/eye irritation]P210, P233, P240, P241, P242, P243, P264, P264+P265, P270, P280, P301+P317, P302+P352, P303+P361+P353, P305+P354+P338, P317, P321, P330, P332+P317, P362+P364, P370+P378, P403+P235, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 40 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.
Hazard Classes and CategoriesFlam. Liq. 3 (100%)Acute Tox. 4 (100%)Skin Irrit. 2 (100%)Eye Dam. 1 (100%)
Wassergefährdungsklasse (WGK)2
TSCA-Inventar-StatusTSCA listed
UN-TransportnummerUN 1993 3/PG 1
Zollcode29214990
R-Sätze (R)10-22-38-41
GefahrensymboleXn
Sicherheitshinweise (S)16-26-36/37/39
Gefahrenklasse3Acute Tox. 4 OralAquatic Chronic 3Eye Dam. 1Flam. Liq. 3Skin Irrit. 2
VerpackungsgruppeⅢ
Lagerklasse3 - Flammable liquids