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4-bromo-2-{[(3,5-dichlorophenyl)amino]methyl}phenol

4-bromo-2-{[(3,5-dichlorophenyl)amino]methyl}phenol

CAS: 298215-62-0

Formula: C13H10BrCl2NO

SMILES: OC1=C(CNC2=CC(Cl)=CC(Cl)=C2)C=C(Br)C=C1

IUPAC: 4-bromo-2-{[(3,5-dichlorophenyl)amino]methyl}phenol

InChI: InChI=1S/C13H10BrCl2NO/c14-9-1-2-13(18)8(3-9)7-17-12-5-10(15)4-11(16)6-12/h1-6,17-18H,7H2

Composition: C (44.99%), H (2.90%), Br (23.02%), Cl (20.43%), N (4.04%), O (4.61%)

Molar Mass: 347.03

Atom Count: 28

Heavy Atom Count: 18

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 344.932282
Formal Charge 0
FSP3 0.08
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 2
InChIKey DLEAMTFAGKHVJR-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 80.08
Topological Polar Surface Area 32.26
Polarizability 30.1
Ring Count 2
Rotatable Bond Count 3

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Purity LeadTime CAS PacketSize UnitPrice
90% <2 Days 298215-62-0 $51.35-$86.31$51.35$63.37$86.31
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