5,6,7,8-Tetrahydro-1-naphthylamin

5-Tetralinylamine

HCID 16671CAS 2217-41-6

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Grundinformationen

Standard-SMILES: Nc1cccc2c1CCCC2
InChIKey: SODWJACROGQSMM-UHFFFAOYSA-N
Summenformel: C10H13N
Durchschnittliche Molmasse: 147,22 g/mol
Monoisotopische Masse: 147,10479942

Namen und Bezeichner

Bevorzugter Name: 5-Tetralinylamine
IUPAC: 5,6,7,8-tetrahydronaphthalen-1-amine
Lokaler Name: 5,6,7,8-Tetrahydro-1-naphthylamin
Englischer Name: 5,6,7,8-Tetrahydro-1-naphthylamine
Summenformel: C10H13N
Molmasse: 147.22

Namen und Synonyme

5,6,7,8-Tetrahydro-1-naphthylamine2217-41-65-Aminotetralin1-Amino-5,6,7,8-tetrahydronaphthalene5-Tetralylamine1-Naphthalenamine, 5,6,7,8-tetrahydro-5,6,7,8-Tetrahydro-1-naphthalenamine5-Amino-1,2,3,4-tetrahydronaphthalene1-NAPHTHYLAMINE, 5,6,7,8-TETRAHYDRO-5-Tetralinylaminealpha-TetrahydronaphthylamineNSC 53503

Weitere Namen anzeigen

Tetralin-5-amineAKOS BBS-00003705TIMTEC-BB SBB0040915,6,7,8-Tetrahydro-1Tetrahydro-1-naphthylaM

EINECS 218-713-2BRN 0387264U0L74S8K6GNSC-535031,2,3,4-Tetrahydro-5-naphthylamine1,2,3,4-Tetrahydro-5-naphthalenamineDTXSID701767014-12-00-02934 (Beilstein Handbook Reference)

Datenbank-Bezeichner

CAS: 2217-41-6
PubChem CID: 16671
DTXSID: DTXSID70176701
UNII: U0L74S8K6G
EC Number: 218-713-2
Nikkaji: J42.466H

Eigenschaften

Berechnete Struktureigenschaften

XLogP: 2,6
Polarare Oberfläche (TPSA): 26 Å²
H-Brücken-Donoren: 1
H-Brücken-Akzeptoren: 1
Frei drehbare Bindungen: 0
Schwere Atome: 11
Formalladung: 0
Komplexität: 133

Experimentelle und physikochemische Eigenschaften

SpringerMaterials PropertiesViscosity

Physikochemische Eigenschaften

Schmelzpunkt: 38 °C · 38 °C(lit.)
Siedepunkt: 275 · 275-277 °C713 mm Hg(lit.)
Dichte: 1 · 1,06 g/cm3
Brechungsindex: 20 · n20/D 1.590(lit.)
Flammpunkt: 230 °F · >230 °F
Löslichkeit: miscible with Alcohol
Aggregatzustand: Liquid
pka: 4.56 · 4.56±0.20(Predicted)
Farbe: Clear yellow to brown
BRN: 387264 · 387264
InChI: 1S/C10H13N/c11-10-7-3-5-8-4-1-2-6-9(8)10/h3,5,7H,1-2,4,6,11H2
InChIKey: SODWJACROGQSMM-UHFFFAOYSA-N
SMILES: Nc1cccc2CCCCc12
CAS Datenbank: 2217 · 2217-41-6(CAS DataBase Reference)
NIST chemische Informationen: 1 · 1-Naphthalenamine, 5,6,7,8-tetrahydro-(2217-41-6)

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 4 Einträge

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 41 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Gefahrenhinweise

Regulatory Information · 2 Einträge

Chemical: 1-Naphthalenamine, 5,6,7,8-tetrahydro-

1-Naphthalenamine, 5,6,7,8-tetrahydro-: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.

Hazard Classes and CategoriesSkin Irrit. 2 (100%)

Sicherheitsdaten

F: 9
wgk: 3
hs_code: 29214990
RTECS-Nr.: QM4780000
risk_code: 36/37/38
hazard_code: Xi
safety_code: 26-36
Speicherklasse: 10 - Combustible liquids

Chemie und Industrie

Anwendungen · 1 Eintrag

Verwenden5,6,7,8-Tetrahydro-1-naphthylamine is used as a reagent in the synthesis of GoSlo-SR-5-69, a potent activator of large conductance Ca2+-activated K+ (BK) channels. 5,6,7,8-Tetrahydro-1-naphthylamine is also used as a reagent in the synthesis of benzopyrans and related compounds as inhibitors of the hypoxia inducible factor pathway.