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6-(trifluoromethoxy)-1,2,3,4-tetrahydroisoquinoline

6-(trifluoromethoxy)-1,2,3,4-tetrahydroisoquinoline

CAS: 215924-74-6

Formula: C10H10F3NO

SMILES: FC(F)(F)OC1=CC=C2CNCCC2=C1

IUPAC: 6-(trifluoromethoxy)-1,2,3,4-tetrahydroisoquinoline

InChI: InChI=1S/C10H10F3NO/c11-10(12,13)15-9-2-1-8-6-14-4-3-7(8)5-9/h1-2,5,14H,3-4,6H2

Composition: C (55.30%), H (4.64%), F (26.24%), N (6.45%), O (7.37%)

Molar Mass: 217.191

Atom Count: 25

Heavy Atom Count: 15

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 217.071448435
Formal Charge 0
FSP3 0.4
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey YUAWGGOYRXDHGZ-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 45.69
Topological Polar Surface Area 21.26
Polarizability 18.41
Ring Count 2
Rotatable Bond Count 2

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Purity LeadTime CAS PacketSize UnitPrice
97% <2 Days 215924-74-6 $966.00-$5,612.00$966.00$1,587.00$5,612.00
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