2-(3-hydroxyphenyl)-6-methyl-1,3,6,2-dioxazaborocane-4,8-dione

2-(3-hydroxyphenyl)-6-methyl-1,3,6,2-dioxazaborocane-4,8-dione

Formula: C11H12BNO5

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

IUPAC: 2-(3-hydroxyphenyl)-6-methyl-1,3,6,2-dioxazaborocane-4,8-dione

InChI: InChI=1S/C11H12BNO5/c1-13-6-10(15)17-12(18-11(16)7-13)8-3-2-4-9(14)5-8/h2-5,14H,6-7H2,1H3

Composition: C (53.05%), H (4.86%), B (4.34%), N (5.62%), O (32.12%)

Molar Mass: 249.03

Atom Count: 30

Heavy Atom Count: 18

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	249.080852
Formal Charge	0
FSP3	0.27
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
InChIKey	NZNGUMOTSLXTJB-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	57.76
Topological Polar Surface Area	76.07
Polarizability	24.49
Ring Count	2
Rotatable Bond Count	1

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Purity	LeadTime	Formula		UnitPrice
98%	<10 Days	C11H12BNO5		Quote Only