4-cyanothiophen-3-ylboronic acid

4-cyanothiophen-3-ylboronic acid

Formula: C5H4BNO2S

SMILES: OB(O)C1=CSC=C1C#N

IUPAC: (4-cyanothiophen-3-yl)boronic acid

InChI: InChI=1S/C5H4BNO2S/c7-1-4-2-10-3-5(4)6(8)9/h2-3,8-9H

Composition: C (39.26%), H (2.64%), B (7.07%), N (9.16%), O (20.92%), S (20.96%)

Molar Mass: 152.96

Atom Count: 14

Heavy Atom Count: 10

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	153.00558
Formal Charge	0
FSP3	0
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
InChIKey	ZNNDMPYROYPFDP-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	33.43
Topological Polar Surface Area	64.25
Polarizability	14.1
Ring Count	1
Rotatable Bond Count	1

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Purity	LeadTime	Formula		UnitPrice
98%	<10 Days	C5H4BNO2S		Quote Only