4-(4-iodophenyl)-2,9,9-trimethyl-3,5-dioxa-4-boratricyclo[6.1.1.0²,?]decane

4-(4-iodophenyl)-2,9,9-trimethyl-3,5-dioxa-4-boratricyclo[6.1.1.0²,?]decane

CAS: 2724208-42-6

Formula: C16H20BIO2

SMILES: CC1(C)C2CC1C1(C)OB(OC1C2)C1=CC=C(I)C=C1

IUPAC: 4-(4-iodophenyl)-2,9,9-trimethyl-3,5-dioxa-4-boratricyclo[6.1.1.0²,?]decane

InChI: InChI=1/C16H20BIO2/c1-15(2)10-8-13(15)16(3)14(9-10)19-17(20-16)11-4-6-12(18)7-5-11/h4-7,10,13-14H,8-9H2,1-3H3

Composition: C (50.30%), H (5.28%), B (2.83%), I (33.22%), O (8.38%)

Molar Mass: 382.05

Atom Count: 40

Heavy Atom Count: 20

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	4
Exact Mass	382.0601
Formal Charge	0
FSP3	0.62
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	JYQNKARMUJKVIN-UHFFFAOYNA-N
Lipinski's Rule of Five
Molar Refractivity	83.32
Topological Polar Surface Area	18.46
Polarizability	34.92
Ring Count	4
Rotatable Bond Count	1

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Purity	LeadTime	CAS	PacketSize	UnitPrice
95%	<2 Days	2724208-42-6		$51.35-$213.04$51.35$53.53$63.37$71.01$86.31$213.04