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2,6-dibromo-4-methanesulfonylaniline

2,6-dibromo-4-methanesulfonylaniline

CAS: 26595-53-9

Formula: C7H7Br2NO2S

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

IUPAC: 2,6-dibromo-4-methanesulfonylaniline

InChI: InChI=1S/C7H7Br2NO2S/c1-13(11,12)4-2-5(8)7(10)6(9)3-4/h2-3H,10H2,1H3

Composition: C (25.55%), H (2.14%), Br (48.57%), N (4.26%), O (9.73%), S (9.74%)

Molar Mass: 329.01

Atom Count: 20

Heavy Atom Count: 13

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 326.856426
Formal Charge 0
FSP3 0.14
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey CNSTWVXFFAFKFG-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 60.01
Topological Polar Surface Area 60.16
Polarizability 23.5
Ring Count 1
Rotatable Bond Count 1

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Purity LeadTime CAS PacketSize UnitPrice
95% <7 Days 26595-53-9 $558.90-$1,351.71$558.90$1,351.71
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