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3,6-dihydro-2H-thiopyran-4-ylboronic acid

3,6-dihydro-2H-thiopyran-4-ylboronic acid

CAS: 1395285-52-5

Formula: C5H9BO2S

SMILES: OB(O)C1=CCSCC1

IUPAC: (3,6-dihydro-2H-thiopyran-4-yl)boronic acid

InChI: InChI=1S/C5H9BO2S/c7-6(8)5-1-3-9-4-2-5/h1,7-8H,2-4H2

Composition: C (41.71%), H (6.30%), B (7.51%), O (22.22%), S (22.26%)

Molar Mass: 144

Atom Count: 18

Heavy Atom Count: 9

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 0
Exact Mass 144.041631
Formal Charge 0
FSP3 0.6
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 2
InChIKey PWPKMXAIUNSIKE-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 36.55
Topological Polar Surface Area 40.46
Polarizability 15.26
Ring Count 1
Rotatable Bond Count 1

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97% <2 Days 1395285-52-5 $342.70-$4,597.70$342.70$1,147.70$4,597.70
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