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(1S)-1-(3-bromophenyl)propan-1-amine

(1S)-1-(3-bromophenyl)propan-1-amine

CAS: 760171-71-9

Formula: C9H12BrN

SMILES: CC[C@H](N)C1=CC=CC(Br)=C1

IUPAC: (1S)-1-(3-bromophenyl)propan-1-amine

InChI: InChI=1S/C9H12BrN/c1-2-9(11)7-4-3-5-8(10)6-7/h3-6,9H,2,11H2,1H3/t9-/m0/s1

Composition: C (50.49%), H (5.65%), Br (37.32%), N (6.54%)

Molar Mass: 214.106

Atom Count: 23

Heavy Atom Count: 11

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 1
Exact Mass 213.015312
Formal Charge 0
FSP3 0.33
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 1
InChIKey MDAOMTRNTRIGOV-VIFPVBQESA-N
Lipinski's Rule of Five 1
Molar Refractivity 51.1
Topological Polar Surface Area 26.02
Polarizability 20.08
Ring Count 1
Rotatable Bond Count 2

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97% <7 Days 760171-71-9 $79.48-$188.87$79.48$188.87
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95% <5 Days 760171-71-9 $303.90-$1,274.87$303.90$484.22$1,274.87
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