(2-Phenylcyclopropyl)methanol

HCID 317540CAS 10488-04-7

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Grundinformationen

Standard-SMILES: OCC1CC1c1ccccc1
InChIKey: CEZOORGGKZLLAO-UHFFFAOYSA-N
Summenformel: C10H12O
Durchschnittliche Molmasse: 148,2 g/mol
Monoisotopische Masse: 148,088815

Namen und Bezeichner

Bevorzugter Name: (2-Phenylcyclopropyl)methanol
IUPAC: (2-phenylcyclopropyl)methanol
Englischer Name: (2-Phenylcyclopropyl)Methanol
Summenformel: C10H12O
Molmasse: 148.2

Namen und Synonyme

(2-phenylcyclopropyl)methanolDTXSID10312101RefChem:396225DTXCID10263225985-263-861826-40-2Cyclopropanemethanol, 2-phenyl-MFCD03931867[(1R,2R)-2-phenylcyclopropyl]methanol((1R,2R)-2-phenylcyclopropyl)methanol2-PHENYLCYCLOPROPANEMETHANOLNSC249802

Weitere Namen anzeigen

(2-Phenylcyclopropyl)

rel-((1R,2R)-2-Phenylcyclopropyl)methanol2-phenylcyclopropylmethanolSCHEMBL1834561(2-phenylcyclopropyl)methan-1-olCEZOORGGKZLLAO-UHFFFAOYSA-NAAA93698KGC73709LCA82640

Datenbank-Bezeichner

CAS: 10488-04-7、61826-40-2
PubChem CID: 317540
DTXSID: DTXSID10312101
EC Number: 190-597-5、985-263-8
Nikkaji: J698.647A

Eigenschaften

Berechnete Struktureigenschaften

XLogP: 1,9
Polarare Oberfläche (TPSA): 20,2 Å²
H-Brücken-Donoren: 1
H-Brücken-Akzeptoren: 1
Frei drehbare Bindungen: 2
Schwere Atome: 11
Formalladung: 0
Komplexität: 127

Physikochemische Eigenschaften

Siedepunkt: 91 · 91-96 °C(Press: 0.3 Torr)
Dichte: 1.044 g/cm3 · 1.044 g/cm3(Temp: 420 °C)
storage temp.: Sealed in dry,Room Temperature
pka: 15.1 · 15.10±0.10(Predicted)

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 5 Einträge

Danger

H302 (50%): Harmful if swallowed [Warning Acute toxicity, oral]；H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H318 (50%): Causes serious eye damage [Danger Serious eye damage/eye irritation]；H319 (50%): 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]

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

Aggregated GHS information provided per 2 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.