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N-{2-[7-(²H?)methoxynaphthalen-1-yl]ethyl}(²H?)acetamide

N-{2-[7-(²H?)methoxynaphthalen-1-yl]ethyl}(²H?)acetamide

CAS: 1079389-42-6

Formula: C15H17NO2

SMILES: [2H]C([2H])([2H])OC1=CC=C2C=CC=C(CCNC(=O)C([2H])([2H])[2H])C2=C1

IUPAC: N-{2-[7-(²H?)methoxynaphthalen-1-yl]ethyl}(²H?)acetamide

InChI: InChI=1S/C15H17NO2/c1-11(17)16-9-8-13-5-3-4-12-6-7-14(18-2)10-15(12)13/h3-7,10H,8-9H2,1-2H3,(H,16,17)/i1D3,2D3

Composition: C (72.26%), H (4.45%), [2H] (4.85%), N (5.62%), O (12.83%)

Molar Mass: 249.343

Atom Count: 35

Heavy Atom Count: 18

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 249.163589267
Formal Charge 0
FSP3 0.27
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey YJYPHIXNFHFHND-WFGJKAKNSA-N
Lipinski's Rule of Five 1
Molar Refractivity 71.64
Topological Polar Surface Area 38.33
Polarizability 28.95
Ring Count 2
Rotatable Bond Count 4

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Purity LeadTime CAS PacketSize UnitPrice
97% <14 Days 1079389-42-6 $142.80-$1,141.38$142.80$1,141.38
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