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4-bromo-3,5-dichlorobenzene-1,2-diamine

4-bromo-3,5-dichlorobenzene-1,2-diamine

CAS: 98138-54-6

Formula: C6H5BrCl2N2

SMILES: NC1=CC(Cl)=C(Br)C(Cl)=C1N

IUPAC: 4-bromo-3,5-dichlorobenzene-1,2-diamine

InChI: InChI=1S/C6H5BrCl2N2/c7-4-2(8)1-3(10)6(11)5(4)9/h1H,10-11H2

Composition: C (28.16%), H (1.97%), Br (31.22%), Cl (27.70%), N (10.95%)

Molar Mass: 255.92

Atom Count: 16

Heavy Atom Count: 11

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 253.901317
Formal Charge 0
FSP3 0
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 2
InChIKey RRKGGVUUZZVSKY-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 52.69
Topological Polar Surface Area 52.04
Polarizability 19.44
Ring Count 1
Rotatable Bond Count 0

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Purity (%)
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Purity LeadTime CAS PacketSize UnitPrice
96% <2 Days 98138-54-6 $286.35-$6,762.00$286.35$457.70$687.70$1,127.00$1,817.00$6,762.00
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