2,5-bis(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)thiophene-3-carbonitrile

2,5-bis(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)thiophene-3-carbonitrile

Formula: C17H25B2NO4S

SMILES: CC1(C)OB(OC1(C)C)C1=CC(C#N)=C(S1)B1OC(C)(C)C(C)(C)O1

IUPAC: 2,5-bis(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)thiophene-3-carbonitrile

InChI: InChI=1S/C17H25B2NO4S/c1-14(2)15(3,4)22-18(21-14)12-9-11(10-20)13(25-12)19-23-16(5,6)17(7,8)24-19/h9H,1-8H3

Composition: C (56.55%), H (6.98%), B (5.99%), N (3.88%), O (17.72%), S (8.88%)

Molar Mass: 361.07

Atom Count: 50

Heavy Atom Count: 25

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	361.169039
Formal Charge	0
FSP3	0.71
Hetero Ring Count	3
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	0
InChIKey	MTFIFMISLUXNDA-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity	86.52
Topological Polar Surface Area	60.71
Polarizability	38.2
Ring Count	3
Rotatable Bond Count	2

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Purity	LeadTime	Formula		UnitPrice
98%	<10 Days	C17H25B2NO4S		Quote Only