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1-bromo-4-(4-chlorobenzenesulfonyl)benzene

1-bromo-4-(4-chlorobenzenesulfonyl)benzene

CAS: 65082-45-3

Formula: C12H8BrClO2S

SMILES: ClC1=CC=C(C=C1)S(=O)(=O)C1=CC=C(Br)C=C1

IUPAC: 1-bromo-4-(4-chlorobenzenesulfonyl)benzene

InChI: InChI=1S/C12H8BrClO2S/c13-9-1-5-11(6-2-9)17(15,16)12-7-3-10(14)4-8-12/h1-8H

Composition: C (43.46%), H (2.43%), Br (24.10%), Cl (10.69%), O (9.65%), S (9.67%)

Molar Mass: 331.61

Atom Count: 25

Heavy Atom Count: 17

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 329.911691
Formal Charge 0
FSP3 0
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 0
InChIKey UGMPHUWLSLSAHB-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 72.02
Topological Polar Surface Area 34.14
Polarizability 29.08
Ring Count 2
Rotatable Bond Count 2

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Purity (%)
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Purity LeadTime CAS PacketSize UnitPrice
95% 1 Day 65082-45-3 $181.44-$1,905.12$181.44$317.52$635.04$1,905.12
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