2-formylthiophen-3-ylboronic acid

2-formylthiophen-3-ylboronic acid

CAS: 4347-31-3

Formula: C5H5BO3S

SMILES: OB(O)C1=C(SC=C1)C=O

IUPAC: (2-formylthiophen-3-yl)boronic acid

InChI: InChI=1S/C5H5BO3S/c7-3-5-4(6(8)9)1-2-10-5/h1-3,8-9H

Composition: C (38.51%), H (3.23%), B (6.93%), O (30.77%), S (20.56%)

Molar Mass: 155.96

Atom Count: 15

Heavy Atom Count: 10

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	156.005245
Formal Charge	0
FSP3	0
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
InChIKey	BBENFHSYKBYWJX-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	34.08
Topological Polar Surface Area	57.53
Polarizability	14.2
Ring Count	1
Rotatable Bond Count	2

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99.35%	<7 Days	4347-31-3		$84.15-$841.50$84.15$158.95$396.44$841.50

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97%	<6 Days	4347-31-3		$8.05-$371.45$8.05$26.45$149.50$371.45

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98%	<5 Days	4347-31-3		$403.00-$480.00$403.00$480.00