4-methylthiophen-2-ylboronic acid tetrahydrate

4-methylthiophen-2-ylboronic acid tetrahydrate

Formula: C5H15BO6S

SMILES: O.O.O.O.CC1=CSC(=C1)B(O)O

IUPAC: (4-methylthiophen-2-yl)boronic acid tetrahydrate

InChI: InChI=1S/C5H7BO2S.4H2O/c1-4-2-5(6(7)8)9-3-4;;;;/h2-3,7-8H,1H3;4*1H2

Composition: C (28.06%), H (7.06%), B (5.05%), O (44.85%), S (14.98%)

Molar Mass: 214.04

Atom Count: 28

Heavy Atom Count: 13

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	214.068239
Formal Charge	0
FSP3	0.2
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	2
InChIKey	JCBPXUHBGVRJCV-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	31.91
Topological Polar Surface Area	40.46
Polarizability	13.98
Ring Count	1
Rotatable Bond Count	1

Suppliers

ChemBridge Corp.

Supplier Profile

Purity	LeadTime	Formula	PacketSize	UnitPrice
95%	<4 Days	C5H15BO6S		$58.65$58.65