(6-Hydroxynaphthalen-2-yl)boronic acid
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Grundinformationen
- CAS
173194-95-1- Standard-SMILES
OB(O)c1ccc2cc(O)ccc2c1- InChIKey
SNJANQMHRGSHFN-UHFFFAOYSA-N- Summenformel
- C10H9BO3
- Durchschnittliche Molmasse
- 187,99 g/mol
- Monoisotopische Masse
- 188,0644743
Namen und Bezeichner
- Bevorzugter Name
- (6-Hydroxynaphthalen-2-yl)boronic acid
- IUPAC
- (6-hydroxynaphthalen-2-yl)boronic acid
- Englischer Name
- 6-HYDROXY-2-NAPHTHALENEBORONIC ACID
- Summenformel
- C10H9BO3
- Molmasse
- 187.99
Namen und Synonyme
173194-95-1(6-hydroxynaphthalen-2-yl)boronic AcidEC 687-349-8DTXSID60402228RefChem:405057DTXCID00353083687-349-86-Hydroxy-2-naphthaleneboronic acid6-Hydroxynaphthalene-2-boronic acid6-hydroxynaphthalen-2-ylboronic acidMFCD00092986Boronic acid, B-(6-hydroxy-2-naphthalenyl)-
Weitere Namen anzeigen
EOS-61102AKOS BRN-04306-Hydroxy-2-naphthoboric acid6-HYDROXY-2-NAPHTALENEBORONIC ACID6-HYDROXY-2-NAPTHALENE BORONIC ACID6-HYDROXY-2-NAPHTHYLENEBORONIC ACID
6-Hydroxy-2-naphthaleneboronicacidC10H9BO3(6-HYDROXY-2-NAPHTHYL)BORONIC ACID6-Hydroxyl-2-naphthaleneboronicacidBoronic acid, (6-hydroxy-2-naphthalenyl)-Boronic acid,B-(6-hydroxy-2-naphthalenyl)-(6-hydroxy-2-naphthalenyl)boronic acidSCHEMBL8649
Datenbank-Bezeichner
- CAS
173194-95-1- PubChem CID
- 4349738
- DTXSID
DTXSID60402228- EC Number
Eigenschaften
Berechnete StruktureigenschaftenWird ergänzt
- Polarare Oberfläche (TPSA)
- 60,7 Ų
- H-Brücken-Donoren
- 3
- H-Brücken-Akzeptoren
- 3
- Frei drehbare Bindungen
- 1
- Schwere Atome
- 14
- Formalladung
- 0
- Komplexität
- 198
Physikochemische Eigenschaften
- Schmelzpunkt
- 218 · 218-224°C
- Siedepunkt
- 458.6 · 458.6±37.0 °C(Predicted)
- Dichte
- 1.35 · 1.35±0.1 g/cm3(Predicted)
- storage temp.
- Keep in dark place,Sealed in dry,Room Temperature
- pka
- 8.8 · 8.80±0.30(Predicted)
- Aggregatzustand
- powder to crystal
- Farbe
- Light yellow to Yellow to Orange
- InChI
- 1S/C10H9BO3/c12-10-4-2-7-5-9(11(13)14)3-1-8(7)6-10/h1-6,12-14H
- InChIKey
- SNJANQMHRGSHFN-UHFFFAOYSA-N
- SMILES
- OB(O)c1ccc2cc(O)ccc2c1
- LogP
- 2.47 at · 2.47 at 21.6℃
- CAS Datenbank
- 173194 · 173194-95-1(CAS DataBase Reference)
Sicherheit und Regulatorisches
Sicherheitsangaben dienen nur zur Orientierung und ersetzen weder das Sicherheitsdatenblatt (SDB) des Lieferanten noch geltende Vorschriften oder eine fachliche Bewertung.
GHS-Klassifizierung
GHS Classification
Warning
H302 (18.5%): Harmful if swallowed [Warning Acute toxicity, oral]；H315 (85.2%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (83.3%): 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 54 reports by companies from 7 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.
Gefahrenhinweise
Regulatory InformationStatus: Active Update: 21-12-2015 https://echa.europa.eu/registration-dossier/-/registered-dossier/7159
Hazard Classes and CategoriesAcute Tox. 4 (18.5%)；Skin Irrit. 2 (85.2%)；Eye Irrit. 2A (100%)；STOT SE 3 (83.3%)
Regulatorische Informationen
Regulatory InformationStatus: Active Update: 21-12-2015 https://echa.europa.eu/registration-dossier/-/registered-dossier/7159
Sicherheitsdaten
Chemie und Industrie
Anwendungen
Verwenden6-Hydroxynaphthalene-2-boronic acid can be used to synthesize inhibitors for oxygenase, tyrosine and phosphoinositide kinases. Tyrosine and phosphoinositide kinases are an attractive target for developing cancer drugs.
Vor- und nachgelagerte Produkte
Vorgelagerte Rohstoffe
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梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
杭州鸿喜生物医药科技有限公司18989489206 · [email protected]
湖北威德利化学试剂有限公司186-02735115 18062128043 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]
INTATRADE GmbH
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