1-Aminotetralin, (R)-

HCID 7058072CAS 23357-46-2

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Grundinformationen

Standard-SMILES: N[C@@H]1CCCc2ccccc21
InChIKey: JRZGPXSSNPTNMA-SNVBAGLBSA-N
Summenformel: C10H13N
Durchschnittliche Molmasse: 147,22 g/mol
Monoisotopische Masse: 147,10479942

Namen und Bezeichner

Bevorzugter Name: 1-Aminotetralin, (R)-
IUPAC: (1R)-1,2,3,4-tetrahydronaphthalen-1-amine
Englischer Name: (R)-(-)-1,2,3,4-Tetrahydro-1-naphthylamine
Summenformel: C10H13N
Molmasse: 147.22

Namen und Synonyme

23357-46-2(R)-(-)-1,2,3,4-Tetrahydro-1-naphthylamine(R)-1-aminotetralin(R)-1,2,3,4-Tetrahydro-1-naphthylamine1-Aminotetralin, (R)-1-Naphthalenamine, 1,2,3,4-tetrahydro-, (1R)-F59J0838WR(-)-1-AMINOTETRALIN1-AMINOTETRALIN, (-)-EC 628-771-4(1r)-1,2,3,4-tetrahydro-1-naphthylamine(1R)-1,2,3,4-TETRAHYDRO-.ALPHA.-NAPHTHYLAMINE

Weitere Namen anzeigen

(R)-1-AMINOTETRALINER-tetralin amine(1R)-tetralin-1-amine(R)-(+)-1-AMINOTETRALIN(R)-(-)-1-AMINOTETRALIN(R)-(-)-1-AMINOTETRALINE(r)-(-)-1-aminotetralin tm(R)-1, 2, 3, 4- Tetrahydro- 1-

RefChem:429455(1R)-1,2,3,4-TETRAHYDRO-ALPHA-NAPHTHYLAMINE628-771-4(R)-1,2,3,4-tetrahydronaphthalen-1-amine(1R)-1,2,3,4-tetrahydronaphthalen-1-amine(R)-1-Amino-1,2,3,4-tetrahydronaphthaleneMFCD00671629CHEMBL289966

Datenbank-Bezeichner

CAS: 23357-46-2
PubChem CID: 7058072
DTXSID: DTXSID201335739
ChEMBL: CHEMBL289966
UNII: F59J0838WR
EC Number: 628-771-4
Nikkaji: J835.611D

Eigenschaften

Berechnete Struktureigenschaften

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

Physikochemische Eigenschaften

Schmelzpunkt: 116 · 116-119 °C
Siedepunkt: 118 · 118-120 °C/10 mbar
Dichte: 1.002 g/mL · 1.002 g/mL at 25 °C
Brechungsindex: 1.565 · 1.565
Flammpunkt: 110 °C · >110°C
storage temp.: Keep in dark place,Inert atmosphere,Room temperature
Aggregatzustand: clear liquid
pka: 9.39 · 9.39±0.20(Predicted)
Farbe: Colorless to Light yellow to Light orange
Wasserlöslichkeit: Soluble in water (6.91g/L at 25°C).
BRN: 4231302 · 4231302
InChI: InChI=1S/C10H13N/c11-10-7-3-5-8-4-1-2-6-9(8)10/h1-2,4,6,10H,3,5,7,11H2/t10-/m1/s1
InChIKey: JRZGPXSSNPTNMA-SNVBAGLBSA-N
SMILES: [C@H]1(N)C2=C(C=CC=C2)CCC1
CAS Datenbank: 23357 · 23357-46-2(CAS DataBase Reference)

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 4 Einträge

Danger

H302 (96.7%): Harmful if swallowed [Warning Acute toxicity, oral]

P260, P261, P264, P264+P265, P270, P271, P273, P280, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P351+P338, P305+P354+P338, P316, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P363, P391, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 151 reports by companies from 7 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Gefahrenhinweise

Regulatory InformationStatus: Active Update: 06-11-2012 https://echa.europa.eu/registration-dossier/-/registered-dossier/11739

Hazard Classes and CategoriesAcute Tox. 4 (96.7%)

Sicherheitsdaten

wgk: 3
ridadr: UN 3082
hs_code: 2921450090
risk_code: 36/37-51/53-36/37/38-52/53-34-22
hazard_code: Xi,N,C
safety_code: 26-36/37/39-61-45
hazard_class: 8
packing_group: Ⅲ
Speicherklasse: 8A - Combustible corrosive hazardous materials
Hazard Classifications: Acute Tox. 4 OralAquatic Chronic 3Skin Corr. 1C

Chemie und Industrie

Anwendungen · 1 Eintrag

Verwenden(R)-(-)-1,2,3,4-Tetrahydro-1-naphthylamine is a important organic intermediate. It can be used in agrochemical, pharmaceutical and dyestuff field. Chiral amines play an important role in stereoselective organic synthesis. They are used directly as resolving agents, building blocks or chiral auxiliaries.