4-(1,3,2-dioxaborinan-2-yl)phenol

4-(1,3,2-dioxaborinan-2-yl)phenol

CAS: 1640035-73-9

Formula: C9H11BO3

SMILES: OC1=CC=C(C=C1)B1OCCCO1

IUPAC: 4-(1,3,2-dioxaborinan-2-yl)phenol

InChI: InChI=1S/C9H11BO3/c11-9-4-2-8(3-5-9)10-12-6-1-7-13-10/h2-5,11H,1,6-7H2

Composition: C (60.73%), H (6.23%), B (6.07%), O (26.97%)

Molar Mass: 177.99

Atom Count: 24

Heavy Atom Count: 13

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	178.080124
Formal Charge	0
FSP3	0.33
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	YLDVLLNEXMTXBY-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	44.45
Topological Polar Surface Area	38.69
Polarizability	19.08
Ring Count	2
Rotatable Bond Count	1

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Purity	LeadTime	CAS	PacketSize	UnitPrice
98%	<5 Days	1640035-73-9		$95.84$95.84