6-methyl-2-phenyl-1,3,6,2-dioxazaborocane-4,8-dione

6-methyl-2-phenyl-1,3,6,2-dioxazaborocane-4,8-dione

CAS: 109737-57-7

Formula: C11H12BNO4

SMILES: CN1CC(=O)OB(OC(=O)C1)C1=CC=CC=C1

IUPAC: 6-methyl-2-phenyl-1,3,6,2-dioxazaborocane-4,8-dione

InChI: InChI=1S/C11H12BNO4/c1-13-7-10(14)16-12(17-11(15)8-13)9-5-3-2-4-6-9/h2-6H,7-8H2,1H3

Composition: C (56.70%), H (5.19%), B (4.64%), N (6.01%), O (27.46%)

Molar Mass: 233.03

Atom Count: 29

Heavy Atom Count: 17

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	233.085938
Formal Charge	0
FSP3	0.27
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
InChIKey	AISHCGVNWMRLOM-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	55.78
Topological Polar Surface Area	55.84
Polarizability	23.85
Ring Count	2
Rotatable Bond Count	1

Suppliers

AA BLOCKS INC

Supplier Profile

Purity	LeadTime	CAS	PacketSize	UnitPrice
97%	<6 Days	109737-57-7		$27.60-$693.45$27.60$50.60$152.95$301.30$693.45

Molecule Market Select

Purity	LeadTime	CAS	PacketSize	UnitPrice
95%	<7 Days	109737-57-7		$37.26-$520.61$37.26$141.80$520.61