N-Methylnaphthalin-1-methylamin

N-Methyl-N-naphthylmethylamine

HCID 84474CAS 14489-75-9

Teilstruktursuche Ähnliche Strukturen suchen

Grundinformationen

Standard-SMILES: CNCc1cccc2ccccc12
InChIKey: MQRIUFVBEVFILS-UHFFFAOYSA-N
Summenformel: C12H13N
Durchschnittliche Molmasse: 171,24 g/mol
Monoisotopische Masse: 171,10479942

Namen und Bezeichner

Bevorzugter Name: N-Methyl-N-naphthylmethylamine
IUPAC: N-methyl-1-naphthalen-1-ylmethanamine
Lokaler Name: N-Methylnaphthalin-1-methylamin
Englischer Name: 1-Methyl-aminomethyl naphthalene
Summenformel: C12H13N
Molmasse: 171.24

Namen und Synonyme

N-Methyl-N-naphthylmethylamine1-Naphthalenemethanamine, N-methyl-N-Methylnaphthalene-1-methylamineDWX2R0PS9PEINECS 238-497-3NSC-129392DTXSID00162834EC 238-497-3NSC 129392N-METHYL-C-(NAPHTHALEN-1-YL)METHANAMINEN-METHYL-N-((NAPHTHALEN-1-YL)METHYL)AMINETERBINAFINE HYDROCHLORIDE IMPURITY A [EP IMPURITY]

Weitere Namen anzeigen

N-METHYL-1-NAPHTHALENEMETHYLAMINECL134ene-1-methyLN-Methyl NaphAURORA KA-7760TIMTEC-BB SBB0057651-Methyl-aminomethylTerbinafine EP Impurity AN-methyl hydrochloric salt

TERBINAFINE HYDROCHLORIDE IMPURITY A (EP IMPURITY)TERBINAFINE HYDROCHLORIDE IMPURITY, N-METHYL-C-(NAPHTHALEN-1-YL)METHANAMINE-(USP IMPURITY)TERBINAFINE HYDROCHLORIDE IMPURITY, N-METHYL-C-(NAPHTHALEN-1-YL)METHANAMINE-[USP IMPURITY]RefChem:830628DTXCID008532514489-75-9N-methyl-1-(naphthalen-1-yl)methanamineN-Methyl-1-naphthylmethylamine

Datenbank-Bezeichner

CAS: 14489-75-9
PubChem CID: 84474
DTXSID: DTXSID00162834
UNII: DWX2R0PS9P
EC Number: 238-497-3
Nikkaji: J241.269A

Eigenschaften

Berechnete Struktureigenschaften

XLogP: 2,6
Polarare Oberfläche (TPSA): 12 Å²
H-Brücken-Donoren: 1
H-Brücken-Akzeptoren: 1
Frei drehbare Bindungen: 2
Schwere Atome: 13
Formalladung: 0
Komplexität: 155

Physikochemische Eigenschaften

Schmelzpunkt: 189.5 · 189.5-190 °C
Siedepunkt: 104 °C · 104 °C
Dichte: 1 · 1,05 g/cm3
Brechungsindex: 1.616 · 1.6160-1.6190
storage temp.: 2 · under inert gas (nitrogen or Argon) at 2–8 °C
Löslichkeit: Chloroform (Slightly), Ethyl Acetate (Slightly)
Aggregatzustand: clear liquid
pka: 9.38 · 9.38±0.10(Predicted)
Farbe: Colorless to Orange to Green
PH: 10.71 at · 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 · 14489-75-9(CAS DataBase Reference)

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 4 Einträge

Danger

H301 (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.