1,4-Benzodioxane-6-boronic acid
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1,4-Benzodioxane-6-boronic acid
structure -
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CAS No:
164014-95-3
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Formula:
C8H9BO4
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Chemical Name:
1,4-Benzodioxane-6-boronic acid
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Synonyms:
(1,4-BENZODIOXAN-6-YL)BORONIC ACID;1,4-BENZODIOXANE-6-BORONIC ACID;2,3-DIHYDROBENZO[B][1,4]DIOXIN-6-YLBORONIC ACID;2,3-DIHYDRO-1,4-BENZODIOXIN-6-YLBORONIC ACID;3,4-(ETHYLENEDIOXY)BENZENEBORONIC ACID;1,4-benzodioxan-6-boronic acid;2,3-Dihydro-1,4-benzodioxine-6-boronicacid;2，3-dihydro –benzo[b][1.4]dioxin-6-yl-6-boronic acid
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CAS No:
1,4-Benzodioxane-6-boronic acid Basic Attributes
179.97
180.059387
7478648
-0
DTXSID00379869
29163990
Characteristics
58.9
-0.86240
White to light yellow crystal powder
1.35±0.1 g/cm3(Predicted)
187 °C
361.0±52.0 °C(Predicted)
172.2±30.7 °C
1.575
7.64E-06mmHg at 25°C
Safety Information
IRRITANT
NONH for all modes of transport
3
36/37/38
26-36/37-37/39
Xi
Irritant
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 45 companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Computed Properties
Molecular Weight:179.97
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:1
Exact Mass:180.0593889
Monoisotopic Mass:180.0593889
Topological Polar Surface Area:58.9
Heavy Atom Count:13
Complexity:176
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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