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[(3-bromo-4-fluorophenyl)methyl]diethylamine

[(3-bromo-4-fluorophenyl)methyl]diethylamine

Formula: C11H15BrFN

SMILES: CCN(CC)CC1=CC(Br)=C(F)C=C1

IUPAC: [(3-bromo-4-fluorophenyl)methyl]diethylamine

InChI: InChI=1S/C11H15BrFN/c1-3-14(4-2)8-9-5-6-11(13)10(12)7-9/h5-7H,3-4,8H2,1-2H3

Composition: C (50.79%), H (5.81%), Br (30.71%), F (7.30%), N (5.38%)

Molar Mass: 260.15

Atom Count: 29

Heavy Atom Count: 14

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 259.037191
Formal Charge 0
FSP3 0.45
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 0
InChIKey AXJLCLSBXOJIQZ-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 61.94
Topological Polar Surface Area 3.24
Polarizability 23.5
Ring Count 1
Rotatable Bond Count 4

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Purity (%)
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Molecule Market Select
Purity LeadTime Formula UnitPrice
98% <10 Days C11H15BrFN Quote Only