2-fluoro-3-methoxyphenylboronic acid CAS#: 352303-67-4; ChemWhat Code: 62431

IdentificationPhysical DataSpectra
Route of Synthesis (ROS)Safety and HazardsOther Data

Identification

Product Name2-fluoro-3-methoxyphenylboronic acid
IUPAC Name(2-fluoro-3-methoxyphenyl)boronic acid
Molecular StructureStructure of 2-fluoro-3-methoxyphenylboronic acid CAS 352303-67-4
CAS Registry Number 352303-67-4
EINECS Number609-099-0
MDL NumberMFCD02094728
Beilstein Registry NumberNo data available
Synonyms(2-fluoro-3-methoxyphenyl)boronic acid, 2-fluoro-3-methoxy-benzeneboronic acid, 2-fluoro-3-methoxybenzene boronic acid, 2-fluoro-3-methoxybenzeneboronic acid, 2-fluoro-3-methoxyphenyl boronic acid, 2-fluoro-3-methoxyphenylboronic acid, 2-fluoro-3-(methoxy)phenylboronic acid
Molecular FormulaC7H8BFO3
Molecular Weight169.946
InChIInChI=1S/C7H8BFO3/c1-12-6-4-2-3-5(7(6)9)8(10)11/h2-4,10-11H,1H3
InChI KeyJCKZNMSBFBPDPM-UHFFFAOYSA-N
Canonical SMILESB(c1cccc(c1F)OC)(O)O
Patent Information
Patent IDTitlePublication Date
US2018/177784HETEROCYCLIC COMPOUNDS AS IMMUNOMODULATORS2018
US2008/318943COMPOUNDS AND USES THEREOF – 8482008
WO2007/145569AMINO-IMIDAZOLONES AND THEIR USE AS A MEDICAMENT FO TREATING COGNITIVE IMPAIRMENT. ALZHEIMER DISEASE, NEURODE ENERATION AND DEMENTIA.2007
WO2006/10637PYRIDINYLAMINES2006

Physical Data

AppearanceWhite or off-white powder
SolubilityNo data available
Melting Point117-122°C
Boiling Point326.8±52.0 °C(Predicted)
Refractive indexNo data available
SensitivityNo data available

Spectra

No data available

Route of Synthesis (ROS)

No data available

Safety and Hazards

Pictogram(s)exclamation-mark
SignalWarning
GHS Hazard StatementsH302 (12.5%): Harmful if swallowed [Warning Acute toxicity, oral]
H315 (87.5%): Causes skin irritation [Warning Skin corrosion/irritation]
H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
H335 (75%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
Information may vary between notifications depending on impurities, additives, and other factors.
Precautionary Statement CodesP261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501
(The corresponding statement to each P-code can be found at the GHS Classification page.)

Other Data

TransportationNONH for all modes of transport
Under the room temperature and away from light
HS CodeNo data available
StorageStored below 0 ℃, filled with inert gas protection and away from light.
Shelf Life1 year
Market PriceUSD
Druglikeness
Lipinski rules component
Molecular Weight169.948
logP1.123
HBA2
HBD2
Matching Lipinski Rules4
Veber rules component
Polar Surface Area (PSA)49.69
Rotatable Bond (RotB)2
Matching Veber Rules2
Use Pattern
2-fluoro-3-methoxyphenylboronic acid CAS#: 352303-67-4 used as an intermediate of API, Elagolix

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