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1-(2,6-dimethylphenoxy)(²H?)propan-2-amine hydrochloride

1-(2,6-dimethylphenoxy)(²H?)propan-2-amine hydrochloride

CAS: 1329835-60-0

Formula: C11H18ClNO

SMILES: Cl.[2H]C([2H])([2H])C([2H])(N)C([2H])([2H])OC1=C(C)C=CC=C1C

IUPAC: 1-(2,6-dimethylphenoxy)(²H?)propan-2-amine hydrochloride

InChI: InChI=1/C11H17NO.ClH/c1-8-5-4-6-9(2)11(8)13-7-10(3)12;/h4-6,10H,7,12H2,1-3H3;1H/i3D3,7D2,10D;

Composition: C (59.58%), H (5.45%), [2H] (5.45%), Cl (15.99%), N (6.32%), O (7.21%)

Molar Mass: 221.76

Atom Count: 32

Heavy Atom Count: 14

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 1
Exact Mass 221.1453524
Formal Charge 0
FSP3 0.45
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey NFEIBWMZVIVJLQ-SJPQGYSLNA-N
Lipinski's Rule of Five 1
Molar Refractivity 54.97
Topological Polar Surface Area 35.25
Polarizability 21.61
Ring Count 1
Rotatable Bond Count 3

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Purity (%)
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CLEARSYNTH LABS
Purity LeadTime CAS PacketSize UnitPrice
97% <14 Days 1329835-60-0 $146.88-$1,137.30$146.88$1,137.30
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