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3-{[(3-bromophenyl)methyl]amino}propan-1-ol

3-{[(3-bromophenyl)methyl]amino}propan-1-ol

Formula: C10H14BrNO

SMILES: OCCCNCC1=CC=CC(Br)=C1

IUPAC: 3-{[(3-bromophenyl)methyl]amino}propan-1-ol

InChI: InChI=1S/C10H14BrNO/c11-10-4-1-3-9(7-10)8-12-5-2-6-13/h1,3-4,7,12-13H,2,5-6,8H2

Composition: C (49.20%), H (5.78%), Br (32.73%), N (5.74%), O (6.55%)

Molar Mass: 244.132

Atom Count: 27

Heavy Atom Count: 13

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 243.025877
Formal Charge 0
FSP3 0.4
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 2
InChIKey IREOYKARTHTUIO-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 58.09
Topological Polar Surface Area 32.26
Polarizability 22.58
Ring Count 1
Rotatable Bond Count 5

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Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C10H14BrNO $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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