4-BENZYLOXY-3-CHLOROPHENYLBORONIC ACID
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4-BENZYLOXY-3-CHLOROPHENYLBORONIC ACID
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CAS No:
845551-44-2
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Formula:
C13H12BClO3
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Chemical Name:
4-BENZYLOXY-3-CHLOROPHENYLBORONIC ACID
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Synonyms:
AKOS BRN-0594;(3-CHLORO-4-BENZYLOXYPHENYL)BORONIC ACID;4-BENZYLOXY-3-CHLOROPHENYLBORONIC ACID;4-Benzyloxy-3-chlorophenylboro;B-[3-chloro-4-(phenylmethoxy)phenyl]-Boronic acid;4-Benzyloxy-3-chlorobenzeneboronic acid, 98%;4-Benzyloxy-3-chlorophenylboronic Acid (contains varying amounts of Anhydride)
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CAS No:
Characteristics
49.7
3.70
1.3±0.1 g/cm3
188-193 °C(lit.)
450.2±55.0 °C at 760 mmHg
226.1±31.5 °C
1.606
Safety Information
IRRITANT
NONH for all modes of transport
3
36/37/38
26-36/37/39
Xi
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 43 companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Computed Properties
Molecular Weight:262.50
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:262.0568021
Monoisotopic Mass:262.0568021
Topological Polar Surface Area:49.7
Heavy Atom Count:18
Complexity:246
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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4-BENZYLOXY-3-CHLOROPHENYLBORONIC ACID
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