5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine-3-carbaldehyde

5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine-3-carbaldehyde

CAS: 848093-29-8

Formula: C12H16BNO3

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

IUPAC: 5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine-3-carbaldehyde

InChI: InChI=1S/C12H16BNO3/c1-11(2)12(3,4)17-13(16-11)10-5-9(8-15)6-14-7-10/h5-8H,1-4H3

Composition: C (61.84%), H (6.92%), B (4.64%), N (6.01%), O (20.59%)

Molar Mass: 233.07

Atom Count: 33

Heavy Atom Count: 17

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	233.122323
Formal Charge	0
FSP3	0.5
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
InChIKey	WVIMCYHOZKNOCS-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	60.14
Topological Polar Surface Area	48.42
Polarizability	25
Ring Count	2
Rotatable Bond Count	2

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