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methyl 2-[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-yl]acetate

methyl 2-[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-yl]acetate

CAS: 1428761-14-1

Formula: C14H20BNO4

SMILES: COC(=O)CC1=CC=C(C=N1)B1OC(C)(C)C(C)(C)O1

IUPAC: methyl 2-[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-yl]acetate

InChI: InChI=1S/C14H20BNO4/c1-13(2)14(3,4)20-15(19-13)10-6-7-11(16-9-10)8-12(17)18-5/h6-7,9H,8H2,1-5H3

Composition: C (60.68%), H (7.27%), B (3.90%), N (5.05%), O (23.09%)

Molar Mass: 277.13

Atom Count: 40

Heavy Atom Count: 20

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 277.148538
Formal Charge 0
FSP3 0.57
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 0
InChIKey JTRYMPVRASMMPR-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 69.26
Topological Polar Surface Area 57.65
Polarizability 29.4
Ring Count 2
Rotatable Bond Count 4

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96% <5 Days 1428761-14-1 $136.19-$625.46$136.19$243.37$625.46
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