Ethyl (R)-2-hydroxy-4-phenylbutyrate

HCID 2733848CAS 90315-82-5

Grundinformationen

Standard-SMILES
CCOC(=O)[C@H](O)CCc1ccccc1
InChIKey
ZJYKSSGYDPNKQS-LLVKDONJSA-N
Summenformel
C12H16O3
Durchschnittliche Molmasse
208,25 g/mol
Monoisotopische Masse
208,10994437

Namen und Bezeichner

Bevorzugter Name
Ethyl (R)-2-hydroxy-4-phenylbutyrate
IUPAC
ethyl (2R)-2-hydroxy-4-phenylbutanoate
Englischer Name
Ethyl (R)-2-hydroxy-4-phenylbutyrate
Summenformel
C12H16O3
Molmasse
208.26

Namen und Synonyme

90315-82-5Ethyl (R)-2-Hydroxy-4-phenylbutyrateQP7IWH2QOXEthyl 2-hydroxy-4-phenylbutyrate, (2R)-(R)-HPBERefChem:593165618-525-4ethyl (2R)-2-hydroxy-4-phenylbutanoate(R)-ethyl 2-hydroxy-4-phenylbutanoateethyl (R)-2-hydroxy-4-phenylbutanoate(R)-2-Hydroxy-4-phenylbutyric Acid Ethyl EsterMFCD00077794
Weitere Namen anzeigen
(R)-2-HYDROXY-4-PHENYLBUTYRATERBZLEEthyl (R)-2-hydroxy-Benazepril Impurity 22Nitroxoline Impurity 13R-2-Hydroxy-4-butylphenyacetateEthyl 4-phenyl-2-hydroxybutanoateEthy(R)-2-hydroxy-4-phenybutyrateEthyl(R)-2-Hydroxyl-4-PhenylButyrate
Ethyl (R)-(-)-2-hydroxy-4-phenylbutyrateUNII-QP7IWH2QOXSCHEMBL614649DTXSID20370015EC 618-525-4(R)-(-)-2-Hydroxy-4-phenylbutyric acid ethyl estherCS-W015213ethyl (R)-2-hydrox

Datenbank-Bezeichner

CAS
90315-82-5
PubChem CID
2733848
DTXSID
DTXSID20370015
ChEMBL
CHEMBL4630646
UNII
QP7IWH2QOX
EC Number
618-525-4
Nikkaji
J275.578E

Eigenschaften

Berechnete Struktureigenschaften

XLogP
2,2
Polarare Oberfläche (TPSA)
46,5 Ų
H-Brücken-Donoren
1
H-Brücken-Akzeptoren
3
Frei drehbare Bindungen
6
Schwere Atome
15

Physikochemische Eigenschaften

Schmelzpunkt
NA
Siedepunkt
212 °C · 212 °C(lit.)
Dichte
1.075 g/mL · 1.075 g/mL at 20 °C(lit.)
Brechungsindex
20 · n20/D 1.504(lit.)
Flammpunkt
230 °F · >230 °F
storage temp.
-20 °C · Sealed in dry,Store in freezer, under -20°C

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 6 Einträge

This chemical does not meet GHS hazard criteria for 80% (4 of 5) of all reports.

Warning

H315 (20%): Causes skin irritation [Warning Skin corrosion/irritation];H319 (20%): Causes serious eye irritation [Warning Serious eye damage/eye irritation];H335 (20%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

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

Aggregated GHS information provided per 5 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.;Reported as not meeting GHS hazard criteria per 4 of 5 reports by companies.;There is 1 notification provided by 1 of 5 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

Regulatory InformationStatus: Active Update: 09-02-2012 https://echa.europa.eu/registration-dossier/-/registered-dossier/6749
Hazard Classes and CategoriesSkin Irrit. 2 (20%);Eye Irrit. 2 (20%);STOT SE 3 (20%)

Regulatorische Informationen

Regulatory InformationStatus: Active Update: 09-02-2012 https://echa.europa.eu/registration-dossier/-/registered-dossier/6749

Sicherheitsdaten

wgk
3
hs_code
29181990
safety_code
23-24/25
Speicherklasse
10 - Combustible liquids

Chemie und Industrie

Anwendungen

VerwendenEthyl(R)-2-hydroxy-4-phenylbutyrate is used in the preparation of benzothiophenes, benzofurans, and indoles useful in the treatment of insulin resistance and hyperglycemia.

Anbieter50 Anbieter

北京华美互利生物化工010-56205725 · [email protected]
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
INTATRADE GmbH+49 3493/605464 · [email protected]
爱斯特(成都)生物制药股份有限公司+86-28-85122536 85324413 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]

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