Cyclopentanethanol

Cyclopentaneethanol

HCID 69833

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Grundinformationen

CAS: 766-00-7
Standard-SMILES: OCCC1CCCC1
InChIKey: JEXQWCBPEWHFKC-UHFFFAOYSA-N
Summenformel: C7H14O
Durchschnittliche Molmasse: 114,19 g/mol
Monoisotopische Masse: 114,10446507

Namen und Bezeichner

Bevorzugter Name: Cyclopentaneethanol
IUPAC: 2-cyclopentylethanol
Lokaler Name: Cyclopentanethanol
Englischer Name: 2-Cyclopentylethanol
Summenformel: C7H14O
Molmasse: 114.19

Namen und Synonyme

766-00-7CyclopentaneethanolAI3-28619EINECS 212-156-9DTXSID80227399RefChem:580988DTXCID30149890212-156-92-Cyclopentylethanol2-cyclopentylethan-1-ol2-Cyclopentaneethanol2-Cyclopentyl-ethanol

Weitere Namen anzeigen

METHYLCYCLOPENTYLCARBINOLTIMTEC-BB SBB0084592-Cyclopentanethanol2-Cyclopentylethanol,97%CYCLOPENTYLMETHYLCARBINOL

2-HydroxyethylcyclopentaneMFCD00019301Cyclopentylethanolcyclopentane-ethanol(2-cyclopentyl)ethyl alcoholSB23028AS-50373EN300-62842

Datenbank-Bezeichner

CAS: 766-00-7
PubChem CID: 69833
DTXSID: DTXSID80227399
EC Number: 212-156-9
Nikkaji: J150.137B

Eigenschaften

Berechnete Struktureigenschaften

XLogP: 2,1
Polarare Oberfläche (TPSA): 20,2 Å²
H-Brücken-Donoren: 1
H-Brücken-Akzeptoren: 1
Frei drehbare Bindungen: 2
Schwere Atome: 8
Formalladung: 0
Komplexität: 55

Physikochemische Eigenschaften

Siedepunkt: 78 · 78-80°C 10mm
Dichte: 0 · 0,92 g/cm3
Brechungsindex: 1.4585 · 1.4585
Flammpunkt: 78 · 78-80°C/10mm
storage temp.: 2 · 2-8°C
Löslichkeit: Chloroform, DMSO, Methanol
Aggregatzustand: Oil
pka: 15.22 · 15.22±0.10(Predicted)
Farbe: Pale Yellow
BRN: 2069860 · 2069860
CAS Datenbank: 766 · 766-00-7(CAS DataBase Reference)

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 5 Einträge

Warning

H227 (100%): Combustible liquid [Warning Flammable liquids]；H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

P210, P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P370+P378, P403, P403+P233, P405, and P501 (click each P-code to see the statement)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Gefahrenhinweise

Hazard Classes and CategoriesFlam. Liq. 4 (100%)；Skin Irrit. 2 (100%)；Eye Irrit. 2A (100%)；STOT SE 3 (100%)

Sicherheitsdaten

hs_code: 2906190090
safety_code: 23-24/25

Chemie und Industrie

Anwendungen · 1 Eintrag

VerwendenCyclopentaneethanol is used in the prepartion of phenylalanine derivatives for incorporation into peptides as CD4 mimetic miniproteins interacting with HIV-1 surface glycoprotein. It is also used in the preparation of tertiary amine muscarinic receptor antagonists applied towards the treatment of chronic obstructive pulmonary disease.