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[1-(4-bromophenyl)propyl](ethyl)amine

[1-(4-bromophenyl)propyl](ethyl)amine

CAS: 915923-68-1

Formula: C11H16BrN

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

IUPAC: [1-(4-bromophenyl)propyl](ethyl)amine

InChI: InChI=1/C11H16BrN/c1-3-11(13-4-2)9-5-7-10(12)8-6-9/h5-8,11,13H,3-4H2,1-2H3

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 1
Exact Mass 241.046613
Formal Charge 0
FSP3 0.45
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 1
InChIKey BSQJEEMOEQKIAK-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 60.62
Topological Polar Surface Area 12.03
Polarizability 23.74
Ring Count 1
Rotatable Bond Count 4

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