[3-Fluoro-4-(methoxycarbonyl)phenyl]boronic acid
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![[3-Fluoro-4-(methoxycarbonyl)phenyl]boronic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/1fd8cbffa9954dc9882df63ee1bdcdcd.png "[3-Fluoro-4-(methoxycarbonyl)phenyl]boronic acid")
[3-Fluoro-4-(methoxycarbonyl)phenyl]boronic acid
structure -
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CAS No:
505083-04-5
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Formula:
C8H8BFO4
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Chemical Name:
[3-Fluoro-4-(methoxycarbonyl)phenyl]boronic acid
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Synonyms:
Benzoic acid,4-borono-2-fluoro-,1-methyl ester;[3-Fluoro-4-(methoxycarbonyl)phenyl]boronic acid;3-Fluoro-4-methoxycarbonyl-benzeneboronic acid
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CAS No:
[3-Fluoro-4-(methoxycarbonyl)phenyl]boronic acid Basic Attributes
197.96
197.96
DTXSID00382318
29319090
Characteristics
66.8
-0.70790
1.3±0.1 g/cm3
180-184°C
195.3°C at 760 mmHg
172.6±30.7 °C
1.514
Keep Cold
Safety Information
IRRITANT
NONH for all modes of transport
36/37/38-20/21/22
26-36/37/39-36
Xi,Xn
Irritant/Keep Cold
P261-P305 + P351 + P338
H315-H319-H335
|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 41 companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Computed Properties
Molecular Weight:197.96
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:3
Exact Mass:198.0499671
Monoisotopic Mass:198.0499671
Topological Polar Surface Area:66.8
Heavy Atom Count:14
Complexity:212
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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[3-Fluoro-4-(methoxycarbonyl)phenyl]boronic acid
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