3-(2-Methoxy-phenyl)-propan-1-ol

HCID 254958CAS 10493-37-5

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Grundinformationen

Standard-SMILES: COc1ccccc1CCCO
InChIKey: KCJSIKPCRQDRNX-UHFFFAOYSA-N
Summenformel: C10H14O2
Durchschnittliche Molmasse: 166,22 g/mol
Monoisotopische Masse: 166,09937969

Namen und Bezeichner

Bevorzugter Name: 3-(2-Methoxy-phenyl)-propan-1-ol
IUPAC: 3-(2-methoxyphenyl)propan-1-ol
Englischer Name: 3-(2-Methoxy-phenyl)-propan-1-ol
Summenformel: C10H14O2
Molmasse: 166.22

Namen und Synonyme

3-(2-Methoxy-phenyl)-propan-1-olRefChem:491119634-639-73-(2-methoxyphenyl)propan-1-ol10493-37-5Benzenepropanol, 2-methoxy-2-methoxybenzenepropanol3-(2-Methoxyphenyl)-1-propanol3-Guaiacyl propanol1-Propanol, 3-(o-methoxyphenyl)-MFCD001971083-(2-methoxyphenyl)propanol

Weitere Namen anzeigen

NSC1055192-Methoxybenzene-1-propanol

3-o-Methoxyphenylpropan-1-ol3-o-MethoxyphenNSC798822-MethoxyphenylpropanolSCHEMBL80578CHEMBL82752SCHEMBL5610819SCHEMBL30118916

Datenbank-Bezeichner

CAS: 10493-37-5
PubChem CID: 254958
DTXSID: DTXSID10292035
ChEMBL: CHEMBL82752
EC Number: 634-639-7
Nikkaji: J129.330C

Eigenschaften

Berechnete Struktureigenschaften

XLogP: 2,3
Polarare Oberfläche (TPSA): 29,5 Å²
H-Brücken-Donoren: 1
H-Brücken-Akzeptoren: 2
Frei drehbare Bindungen: 4
Schwere Atome: 12
Formalladung: 0
Komplexität: 114

Experimentelle und physikochemische Eigenschaften

Kovats Retention Index1454

Physikochemische Eigenschaften

storage temp.: Sealed in dry,Room Temperature

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 5 Einträge

Warning

H302 (97.5%): Harmful if swallowed [Warning Acute toxicity, oral]；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]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, 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 40 reports by companies from 3 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.