N-Methylnaphthalin-1-methylamin

N-METHYL-1-NAPHTHALENEMETHYLAMINE · N-METHYL-1-NAPHTHYLMETHYLAMINE · CL134 · ene-1-methyL · N-Methyl Naph · AURORA KA-7760 · TIMTEC-BB SBB005765 · 1-Methyl-aminomethyl

https://huagongshe.com/de/chemical/84474

Molekülstruktur von N-Methylnaphthalin-1-methylamin

Identifikatoren & physikalische Daten

CAS No.	14489-75-9
Summenformel	C12H13N
Durchschnittliche Molmasse	171,24 g/mol
Monoisotopische Masse	171,10479942 g/mol
SMILES	CNCc1cccc2ccccc12
InChIKey	MQRIUFVBEVFILS-UHFFFAOYSA-N
PubChem CID	84474
EC No.	238-497-3
DTXSID	DTXSID00162834
Lokaler Name	N-Methylnaphthalin-1-methylamin

Chemische & physikalische Eigenschaften

XLogP	2,6
Polarare Oberfläche (TPSA)	12
H-Brücken-Donoren	1
H-Brücken-Akzeptoren	1
Frei drehbare Bindungen	2
Schwere Atome	13
Formalladung	0
Komplexität	155
Schmelzpunkt	189.5-190 °C
Siedepunkt	104 °C
Dichte	1,05 g/cm3
Brechungsindex	1.6160-1.6190
Lagerbedingungen	under inert gas (nitrogen or Argon) at 2–8 °C
Löslichkeit	Chloroform (Slightly), Ethyl Acetate (Slightly)
Aggregatzustand	clear liquid
pKa (Säurekonstante)	9.38±0.10(Predicted)
Farbe	Colorless to Orange to Green
pH	10.71 at 24℃ and 10g/L
InChI	InChI=1S/C12H13N/c1-13-9-11-7-4-6-10-5-2-3-8-12(10)11/h2-8,13H,9H2,1H3
InChIKey	MQRIUFVBEVFILS-UHFFFAOYSA-N
SMILES	C1(CNC)=C2C(C=CC=C2)=CC=C1
CAS Datenbank	14489-75-9(CAS DataBase Reference)

Sicherheit & Vorschriften

GHS-Einstufung	DangerH301 (33.3%): Toxic if swallowed [Danger Acute toxicity, oral]P261, P264, P264+P265, P270, P271, P273, P280, P301+P316, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P391, P403+P233, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 12 reports by companies from 8 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Regulatorische Informationen	REACH registered substance: N-methylnaphthalene-1-methylamine (EC: 238-497-3)1-Naphthalenemethanamine, N-methyl-: Does not have an individual approval but may be used under an appropriate group standard
Hazard Classes and Categories	Acute Tox. 3 (33.3%)
Zollcode	2921.49.5000
R-Sätze (R)	36/37/38
Gefahrensymbole	Xi
Sicherheitshinweise (S)	26-36/37/39
Gefahrenklasse	IRRITANT

Anwendungen & Verwendung

Verwenden

Terbinafine EP Impurity A. Terbinafine BP Impurity A. Terbinafine USP Related Compound A