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(²H?)methyl(methyl)(3-{tricyclo[9.4.0.0³,?]pentadeca-1(11),3(8),4,6,9,12,14-heptaen-2-ylidene}propyl)amine hydrochloride

(²H?)methyl(methyl)(3-{tricyclo[9.4.0.0³,?]pentadeca-1(11),3(8),4,6,9,12,14-heptaen-2-ylidene}propyl)amine hydrochloride

CAS: 1184983-42-3

Formula: C20H22ClN

SMILES: Cl.[2H]C([2H])([2H])N(C)CCC=C1C2=C(C=CC=C2)C=CC2=C1C=CC=C2

IUPAC: (²H?)methyl(methyl)(3-{tricyclo[9.4.0.0³,?]pentadeca-1(11),3(8),4,6,9,12,14-heptaen-2-ylidene}propyl)amine hydrochloride

InChI: InChI=1S/C20H21N.ClH/c1-21(2)15-7-12-20-18-10-5-3-8-16(18)13-14-17-9-4-6-11-19(17)20;/h3-6,8-14H,7,15H2,1-2H3;1H/i1D3;

Composition: C (76.29%), H (6.08%), [2H] (1.92%), Cl (11.26%), N (4.45%)

Molar Mass: 314.87

Atom Count: 44

Heavy Atom Count: 22

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 314.1629077
Formal Charge 0
FSP3 0.2
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 0
InChIKey VXEAYBOGHINOKW-NIIDSAIPSA-N
Lipinski's Rule of Five 1
Molar Refractivity 102.62
Topological Polar Surface Area 3.24
Polarizability 35.1
Ring Count 3
Rotatable Bond Count 3

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Purity (%)
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Purity LeadTime CAS PacketSize UnitPrice
97% <14 Days 1184983-42-3 $114.24-$1,339.26$114.24$449.82$1,339.26
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