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3-bromo-N,N-diethyl-4-methylaniline

3-bromo-N,N-diethyl-4-methylaniline

Formula: C11H16BrN

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

IUPAC: 3-bromo-N,N-diethyl-4-methylaniline

InChI: InChI=1S/C11H16BrN/c1-4-13(5-2)10-7-6-9(3)11(12)8-10/h6-8H,4-5H2,1-3H3

Composition: C (54.56%), H (6.66%), Br (33.00%), N (5.78%)

Molar Mass: 242.16

Atom Count: 29

Heavy Atom Count: 13

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 241.046613
Formal Charge 0
FSP3 0.45
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 0
InChIKey PIDKDOWAISFGQM-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 62.65
Topological Polar Surface Area 3.24
Polarizability 23.3
Ring Count 1
Rotatable Bond Count 3

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Purity LeadTime Formula UnitPrice
98% <10 Days C11H16BrN Quote Only