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5,6-dihydro-1,4-dioxin-2-ylboronic acid

5,6-dihydro-1,4-dioxin-2-ylboronic acid

CAS: 2408429-87-6

Formula: C4H7BO4

SMILES: OB(O)C1=COCCO1

IUPAC: (5,6-dihydro-1,4-dioxin-2-yl)boronic acid

InChI: InChI=1S/C4H7BO4/c6-5(7)4-3-8-1-2-9-4/h3,6-7H,1-2H2

Composition: C (36.98%), H (5.43%), B (8.32%), O (49.26%)

Molar Mass: 129.91

Atom Count: 16

Heavy Atom Count: 9

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 0
Exact Mass 130.043739
Formal Charge 0
FSP3 0.5
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 2
InChIKey XIMWELDMIKCCDV-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 35.31
Topological Polar Surface Area 58.92
Polarizability 11.83
Ring Count 1
Rotatable Bond Count 1

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95% <2 Days 2408429-87-6 $227.70-$4,597.70$227.70$342.70$572.70$802.70$1,147.70$4,597.70
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