B(C1=CC2=C(C=C1)OCCO2)(O)O
CAS: 164014-95-3
Nombre: 2,3-dihydro-1,4-benzodioxin-6-ylboronic acid
SMILES: B(C1=CC2=C(C=C1)OCCO2)(O)O

Molecular Processing

Molecular formula
C8H9BO4
Molecular weight
179.97
Exact mass
180.0594
XLogP
-0.86
TPSA
58.92
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
1
Heavy atoms
13
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.25
Molar refractivity
47.26

Supplementary Information

InChIKey: SQDUGGGBJXULJR-UHFFFAOYSA-N
Sinónimos
(2,3-dihydro-1,4-benzodioxin-6-yl)boronic acidRefChem:394491625-755-91,4-Benzodioxane-6-boronic acid164014-95-32,3-dihydro-1,4-benzodioxin-6-ylboronic acid(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)boronic acidMFCD01009696Boronic acid, B-(2,3-dihydro-1,4-benzodioxin-6-yl)-BORONIC ACID, (2,3-DIHYDRO-1,4-BENZODIOXIN-6-YL)-1,4-Benzodioxan-6-boronic acid3,4-(ethylenedioxy)benzeneboronic acid1,4-Benzodioxane-6-boronicacid2,3-dihydro-1,4-(benzodioxin-6-yl)boronic acidSCHEMBL121851orb2940004DTXSID00379869SQDUGGGBJXULJR-UHFFFAOYSA-N3,4-ethylenedioxyphenylboronic acidALBB-012243CS-D1714SBB018828TYD-00575AKOS002659294AB079641,4-Benzodioxane-6-boronic acid, 96%3H-benzo[e]1,4-dioxin-6-boronic acidNCGC00249476-01AS-15068BP-10782
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