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1-bromo-4-methanesulfinylbenzene

1-bromo-4-methanesulfinylbenzene

CAS: 934-71-4

Formula: C7H7BrOS

SMILES: CS(=O)C1=CC=C(Br)C=C1

IUPAC: 1-bromo-4-methanesulfinylbenzene

InChI: InChI=1/C7H7BrOS/c1-10(9)7-4-2-6(8)3-5-7/h2-5H,1H3

Composition: C (38.37%), H (3.22%), Br (36.47%), O (7.30%), S (14.63%)

Molar Mass: 219.1

Atom Count: 17

Heavy Atom Count: 10

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 1
Exact Mass 217.940099
Formal Charge 0
FSP3 0.14
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 0
InChIKey MPOPDYTWAYBUOD-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 48.04
Topological Polar Surface Area 17.07
Polarizability 18.58
Ring Count 1
Rotatable Bond Count 1

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Purity LeadTime CAS PacketSize UnitPrice
98% <7 Days 934-71-4 $9.32-$317.75$9.32$10.35$22.77$79.70$317.75
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97% <2 Days 934-71-4 $51.35-$245.81$51.35$63.37$86.31$245.81
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98% <5 Days 934-71-4 $17.65-$214.37$17.65$68.09$214.37
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