3-(N-METHYLAMINOCARBONYL)PHENYLBORONIC ACID
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3-(N-METHYLAMINOCARBONYL)PHENYLBORONIC ACID
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CAS No:
832695-88-2
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Formula:
C8H10BNO3
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Chemical Name:
3-(N-METHYLAMINOCARBONYL)PHENYLBORONIC ACID
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Synonyms:
3-(N-METHYLAMINOCARBONYL)BENZENEBORONIC ACID;3-(N-METHYLAMINOCARBONYL)PHENYLBORONIC ACID;3-(Methylcarbamoyl)benzeneboronic acid;3-(MethylaMinocarbonyl)benzeneboronic Acid;3-Borono-N-methylbenzamide;[3-(MethylcarbaMoyl)phenyl]boronic acid;[3-(MethylaMinocarbonyl)phenyl]boronic Acid;B-[3-[(MethylaMino)carbonyl]phenyl]boronic Acid
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CAS No:
3-(N-METHYLAMINOCARBONYL)PHENYLBORONIC ACID Basic Attributes
178.98
179.075378
DTXSID90378523
2931900090
Safety Information
36/37/38-43-41-37/38-22
26-36/37/39-39-36/37
Xi,Xn
Irritant
|Warning|H302 (50%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, and P501|Aggregated GHS information provided by 2 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
3-(N-METHYLAMINOCARBONYL)PHENYLBORONIC ACID Use and Manufacturing
Used in the preparation of thiazolopyridinylacetamide derivatives and analogs for use as PI3K and mTOR kinase inhibitors.
Computed Properties
Molecular Weight:178.98
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:179.0753733
Monoisotopic Mass:179.0753733
Topological Polar Surface Area:69.6
Heavy Atom Count:13
Complexity:186
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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3-(N-METHYLAMINOCARBONYL)PHENYLBORONIC ACID
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