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N-[3-(2-bromoacetamido)phenyl]hexanamide

N-[3-(2-bromoacetamido)phenyl]hexanamide

CAS: 1138443-24-9

Formula: C14H19BrN2O2

SMILES: CCCCCC(=O)NC1=CC(NC(=O)CBr)=CC=C1

IUPAC: N-[3-(2-bromoacetamido)phenyl]hexanamide

InChI: InChI=1S/C14H19BrN2O2/c1-2-3-4-8-13(18)16-11-6-5-7-12(9-11)17-14(19)10-15/h5-7,9H,2-4,8,10H2,1H3,(H,16,18)(H,17,19)

Composition: C (51.39%), H (5.85%), Br (24.42%), N (8.56%), O (9.78%)

Molar Mass: 327.222

Atom Count: 38

Heavy Atom Count: 19

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 326.062991
Formal Charge 0
FSP3 0.43
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 2
InChIKey WTWBFHIFDZAMCB-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 81.95
Topological Polar Surface Area 58.2
Polarizability 30.16
Ring Count 1
Rotatable Bond Count 7

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95% <2 Days 1138443-24-9 $212.83$212.83
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