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1-(bromomethyl)-3,5-bis(tert-butylsulfanyl)benzene

1-(bromomethyl)-3,5-bis(tert-butylsulfanyl)benzene

Formula: C15H23BrS2

SMILES: CC(C)(C)SC1=CC(SC(C)(C)C)=CC(CBr)=C1

IUPAC: 1-(bromomethyl)-3,5-bis(tert-butylsulfanyl)benzene

InChI: InChI=1S/C15H23BrS2/c1-14(2,3)17-12-7-11(10-16)8-13(9-12)18-15(4,5)6/h7-9H,10H2,1-6H3

Composition: C (51.87%), H (6.67%), Br (23.00%), S (18.46%)

Molar Mass: 347.37

Atom Count: 41

Heavy Atom Count: 18

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 346.042456
Formal Charge 0
FSP3 0.6
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 0
Hydrogen Bond Donor Count 0
InChIKey HJYIDUVSYYBHAM-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity 92.33
Topological Polar Surface Area 0
Polarizability 35.55
Ring Count 1
Rotatable Bond Count 5

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Purity (%)
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Purity LeadTime Formula UnitPrice
98% <14 Days C15H23BrS2 Quote Only