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7-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2H,4H-pyrido[3,2-b][1,4]oxazin-3-one

7-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2H,4H-pyrido[3,2-b][1,4]oxazin-3-one

CAS: 1443147-02-1

Formula: C13H17BN2O4

SMILES: CC1(C)OB(OC1(C)C)C1=CN=C2NC(=O)COC2=C1

IUPAC: 7-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2H,3H,4H-pyrido[3,2-b][1,4]oxazin-3-one

InChI: InChI=1S/C13H17BN2O4/c1-12(2)13(3,4)20-14(19-12)8-5-9-11(15-6-8)16-10(17)7-18-9/h5-6H,7H2,1-4H3,(H,15,16,17)

Composition: C (56.55%), H (6.21%), B (3.92%), N (10.15%), O (23.18%)

Molar Mass: 276.1

Atom Count: 37

Heavy Atom Count: 20

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 276.128137
Formal Charge 0
FSP3 0.54
Hetero Ring Count 3
Hydrogen Bond Acceptor Count 5
Hydrogen Bond Donor Count 1
InChIKey UJDWNUXIKGSMOI-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 68.64
Topological Polar Surface Area 69.68
Polarizability 27.97
Ring Count 3
Rotatable Bond Count 1

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97% <7 Days 1443147-02-1 $245.91-$873.29$245.91$374.00$873.29
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