2-(5-fluoro-2-methyl-3-nitrophenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

2-(5-fluoro-2-methyl-3-nitrophenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

Formula: C13H17BFNO4

SMILES: CC1=C(C=C(F)C=C1B1OC(C)(C)C(C)(C)O1)[N+]([O-])=O

IUPAC: 2-(5-fluoro-2-methyl-3-nitrophenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

InChI: InChI=1S/C13H17BFNO4/c1-8-10(6-9(15)7-11(8)16(17)18)14-19-12(2,3)13(4,5)20-14/h6-7H,1-5H3

Composition: C (55.55%), H (6.10%), B (3.85%), F (6.76%), N (4.98%), O (22.77%)

Molar Mass: 281.09

Atom Count: 37

Heavy Atom Count: 20

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	281.123466
Formal Charge	0
FSP3	0.54
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
InChIKey	CQPJKJPSEPSFFM-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	67.29
Topological Polar Surface Area	61.6
Polarizability	27.36
Ring Count	2
Rotatable Bond Count	2

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Purity	LeadTime	Formula		UnitPrice
98%	<10 Days	C13H17BFNO4		Quote Only