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

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

Formula: C13H18BNO4

SMILES: CC1=CC(=CC(=C1)B1OC(C)(C)C(C)(C)O1)[N+]([O-])=O

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

InChI: InChI=1S/C13H18BNO4/c1-9-6-10(8-11(7-9)15(16)17)14-18-12(2,3)13(4,5)19-14/h6-8H,1-5H3

Composition: C (59.35%), H (6.90%), B (4.11%), N (5.32%), O (24.32%)

Molar Mass: 263.1

Atom Count: 37

Heavy Atom Count: 19

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	263.132888
Formal Charge	0
FSP3	0.54
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
InChIKey	MXHRQSAUSKGAQV-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	67.07
Topological Polar Surface Area	61.6
Polarizability	27.63
Ring Count	2
Rotatable Bond Count	2

Suppliers

Molecule Market Select

Purity	LeadTime	Formula		UnitPrice
98%	<10 Days	C13H18BNO4		Quote Only