3-fluoro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzaldehyde

3-fluoro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzaldehyde

CAS: 1112209-24-1

Formula: C13H16BFO3

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

IUPAC: 3-fluoro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzaldehyde

InChI: InChI=1S/C13H16BFO3/c1-12(2)13(3,4)18-14(17-12)10-5-9(8-16)6-11(15)7-10/h5-8H,1-4H3

Composition: C (62.44%), H (6.45%), B (4.32%), F (7.60%), O (19.19%)

Molar Mass: 250.08

Atom Count: 34

Heavy Atom Count: 18

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	250.117653
Formal Charge	0
FSP3	0.46
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
InChIKey	WENPYTYJEVDZDV-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	62.51
Topological Polar Surface Area	35.53
Polarizability	25.57
Ring Count	2
Rotatable Bond Count	2

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Purity	LeadTime	CAS	PacketSize	UnitPrice
97%	<5 Days	1112209-24-1		$40.35-$172.76$40.35$65.57$172.76