p-(Phenylthio)benzyl alcohol

HCID 80593CAS 6317-56-2

Grundinformationen

Standard-SMILES
OCc1ccc(Sc2ccccc2)cc1
InChIKey
PGOAWMRWDZJQTB-UHFFFAOYSA-N
Summenformel
C13H12OS
Durchschnittliche Molmasse
216,3 g/mol
Monoisotopische Masse
216,06088618

Namen und Bezeichner

Bevorzugter Name
p-(Phenylthio)benzyl alcohol
IUPAC
(4-phenylsulfanylphenyl)methanol
Englischer Name
p-(phenylthio)benzyl alcohol
Summenformel
C13H12OS
Molmasse
216.3

Namen und Synonyme

6317-56-2p-(Phenylthio)benzyl alcohol4-(Phenylthio)benzyl Alcohol4-(Phenylthio)benzenemethanolbenzenemethanol, 4-(phenylthio)-[4-(phenylsulfanyl)phenyl]methanolNSC 43060TMD9BW7WU5EINECS 228-658-6NSC-43060DTXSID10212511(4-(PHENYLSULFANYL)PHENYL)METHANOL
Weitere Namen anzeigen
(4-(Phenylthio)4-(Phenylthio)Benzyl Chlorideparabenzenethioylbenzenemethylol(4-(chloromethyl)phenyl)(phenyl)sulfane
RefChem:169268DTXCID40135002228-658-6(4-(phenylthio)phenyl)methanol(4-phenylsulfanylphenyl)methanolMFCD04108413[4-(phenylthio)phenyl]methanolNSC43060

Datenbank-Bezeichner

CAS
6317-56-2
PubChem CID
80593
DTXSID
DTXSID10212511
UNII
TMD9BW7WU5
EC Number
228-658-6
Nikkaji
J206.909A

Eigenschaften

Berechnete Struktureigenschaften

XLogP
3,1
Polarare Oberfläche (TPSA)
45,5 Ų
H-Brücken-Donoren
1
H-Brücken-Akzeptoren
2
Frei drehbare Bindungen
3
Schwere Atome
15

Physikochemische Eigenschaften

Schmelzpunkt
46 · 46-48°C
Siedepunkt
390.2 · 390.2±25.0 °C(Predicted)
Dichte
1.21 · 1.21±0.1 g/cm3(Predicted)
storage temp.
-20 °C · Sealed in dry,Store in freezer, under -20°C
Löslichkeit
DMSO (Slightly), Methanol (Slightly)
Aggregatzustand
Solid

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 6 Einträge

This chemical does not meet GHS hazard criteria for 66.7% (2 of 3) of all reports.

Warning

H302 (33.3%): Harmful if swallowed [Warning Acute toxicity, oral];H315 (33.3%): Causes skin irritation [Warning Skin corrosion/irritation];H319 (33.3%): Causes serious eye irritation [Warning Serious eye damage/eye irritation];H335 (33.3%): 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 3 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.;Reported as not meeting GHS hazard criteria per 2 of 3 reports by companies.;There is 1 notification provided by 1 of 3 reports by companies with hazard statement code(s).;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.

Gefahrenhinweise

Hazard Classes and CategoriesAcute Tox. 4 (33.3%);Skin Irrit. 2 (33.3%);Eye Irrit. 2A (33.3%);STOT SE 3 (33.3%)

Sicherheitsdaten

Alarmwort
Warnung
Gefahrenhinweise
Code Gefahrenhinweise Gefahrenklasse Abteilung Alarmwort Symbol P-Code H302

Chemie und Industrie

Anwendungen

VerwendenAn impurity of Fenticonazole nitrate (F279250), a new potent antimycotic compound.

Anbieter50 Anbieter

Shandong chuangyingchemical Co., Ltd.18853181302 · [email protected]
武汉英诺医药科技有限公司+86-027-59232304 15387063101 · [email protected]
合肥翰刚医药科技有限公司+8618062405514 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
湖北科乐精细化工有限公司027-59101668 19945030958 · [email protected]

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