4-Fluoro-3-(hydroxymethyl)benzeneboronic acid

HCID 21865588
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Grundinformationen

CAS
481681-02-1
Standard-SMILES
OCc1cc(B(O)O)ccc1F
InChIKey
PWMOQHMTXJYUGE-UHFFFAOYSA-N
Summenformel
C7H8BFO3
Durchschnittliche Molmasse
169,95 g/mol
Monoisotopische Masse
170,0550524

Namen und Bezeichner

Bevorzugter Name
4-Fluoro-3-(hydroxymethyl)benzeneboronic acid
IUPAC
[4-fluoro-3-(hydroxymethyl)phenyl]boronic acid
Englischer Name
4-Fluoro-3-(hydroxymethyl)benzeneboronic acid
Summenformel
C7H8BFO3
Molmasse
169.95

Namen und Synonyme

4-FLUORO-3-(HYDROXYMETHYL)BENZENEBORONIC ACIDRefChem:523161692-485-6481681-02-1[4-Fluoro-3-(Hydroxymethyl)Phenyl]Boronic Acid4-FLUORO-3-(HYDROXYMETHYL)PHENYLBORONIC ACID4-fluoro-3-hydroxymethylphenylboronic acidMFCD08235075(4-fluoro-3-(hydroxymethyl)phenyl)boronic acidSCHEMBL10192784-Fluoro-3-hydroxymethyl benzene boronic acid4-fluoro-3-hydroxymethyl-benzene-boronic acid
Weitere Namen anzeigen
uoro-3-(hydroxymethyL4-Fluoro-3-(hydroxymethyl)phenyl4-Fluoro-3-(hydroxymethyl)phenylboronic4-Fluoro-3-(hydroxymethyl)phenyl]boronicaci4-Fluoro-3-(hydroxymethyl)benzeneboronicacid98%4-Fluoro-3-(hydroxymethyl)benzeneboronic acid 98%[4-Fluoro-3-(hydroxymethyl)phenyl]boronic acid ,98%Boronic acid, B-[4-fluoro-3-(hydroxymethyl)phenyl]-
N123044-Fluoro-3-(hydroxymethyl)phenylboronic Acid (contains varying amounts of Anhydride)AMY29940Boronic acid, [4-fluoro-3-(hydroxymethyl)phenyl]-SCHEMBL29951218DTXSID60619071SBB088349AKOS006222936

Datenbank-Bezeichner

CAS
481681-02-1
PubChem CID
21865588
DTXSID
DTXSID60619071
EC Number
692-485-6

Eigenschaften

Berechnete Struktureigenschaften

Polarare Oberfläche (TPSA)
60,7 Ų
H-Brücken-Donoren
3
H-Brücken-Akzeptoren
4
Frei drehbare Bindungen
2
Schwere Atome
12

Physikochemische Eigenschaften

Schmelzpunkt
124 · 124-126
Siedepunkt
365.8 · 365.8±52.0 °C(Predicted)
Dichte
1.35 · 1.35±0.1 g/cm3(Predicted)
storage temp.
Keep Cold
pka
8.39 · 8.39±0.10(Predicted)
Aggregatzustand
powder to crystal

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 5 Einträge

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (50%): 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 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.

Gefahrenhinweise

Hazard Classes and CategoriesSkin Irrit. 2 (100%)；Eye Irrit. 2 (100%)；STOT SE 3 (50%)

Sicherheitsdaten

hs_code
2931900090
hazard_code
Xi
hazard_note
Irritant/Keep Cold

Chemie und Industrie

Anwendungen

Verwendensuzuki reaction

Vor- und nachgelagerte Produkte

Anbieter86 Anbieter

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]
河南赢创生物科技有限公司16650615803 · [email protected]
杭州品高化工有限公司0571-87658025 · [email protected]
T&W GROUP021-61551611 13296011611 · [email protected]

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