4-(cyclopropylsulfanyl)phenylboronic acid

4-(cyclopropylsulfanyl)phenylboronic acid

Formula: C9H11BO2S

SMILES: OB(O)C1=CC=C(SC2CC2)C=C1

IUPAC: [4-(cyclopropylsulfanyl)phenyl]boronic acid

InChI: InChI=1S/C9H11BO2S/c11-10(12)7-1-3-8(4-2-7)13-9-5-6-9/h1-4,9,11-12H,5-6H2

Composition: C (55.71%), H (5.71%), B (5.57%), O (16.49%), S (16.52%)

Molar Mass: 194.06

Atom Count: 24

Heavy Atom Count: 13

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	194.057281
Formal Charge	0
FSP3	0.33
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	2
InChIKey	APWUGUMSANWOII-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	50.67
Topological Polar Surface Area	40.46
Polarizability	21.37
Ring Count	2
Rotatable Bond Count	3

Suppliers

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Purity	LeadTime	Formula		UnitPrice
98%	<10 Days	C9H11BO2S		Quote Only