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1-[(²H)oxy]-4-(2-{4-[(²H)oxy](2,3,5,6-²H?)phenyl}(1,1,1,3,3,3-²H?)propan-2-yl)(²H?)benzene

1-[(²H)oxy]-4-(2-{4-[(²H)oxy](2,3,5,6-²H?)phenyl}(1,1,1,3,3,3-²H?)propan-2-yl)(²H?)benzene

CAS: 96210-87-6

Formula: C15H16O2

SMILES: [2H]OC1=C([2H])C([2H])=C(C([2H])=C1[2H])C(C1=C([2H])C([2H])=C(O[2H])C([2H])=C1[2H])(C([2H])([2H])[2H])C([2H])([2H])[2H]

IUPAC: 1-[(²H)oxy]-4-(2-{4-[(²H)oxy](2,3,5,6-²H?)phenyl}(1,1,1,3,3,3-²H?)propan-2-yl)(²H?)benzene

InChI: InChI=1S/C15H16O2/c1-15(2,11-3-7-13(16)8-4-11)12-5-9-14(17)10-6-12/h3-10,16-17H,1-2H3/i1D3,2D3,3D,4D,5D,6D,7D,8D,9D,10D/hD2

Composition: C (73.72%), H (0.00%), [2H] (13.19%), O (13.09%)

Molar Mass: 244.389

Atom Count: 33

Heavy Atom Count: 17

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 244.21545769
Formal Charge 0
FSP3 0.2
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 2
InChIKey IISBACLAFKSPIT-MAJJRYNQSA-N
Lipinski's Rule of Five 1
Molar Refractivity 79.28
Topological Polar Surface Area 40.46
Polarizability 26.59
Ring Count 2
Rotatable Bond Count 2

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Purity (%)
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Purity LeadTime CAS PacketSize UnitPrice
97% <7 Days 96210-87-6 $46.75-$243.10$46.75$93.50$149.60$243.10
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Molecule Market Select
Purity LeadTime CAS PacketSize UnitPrice
98% <7 Days 96210-87-6 $1,439.69-$2,463.30$1,439.69$2,463.30
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