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3-(3-methylpiperidin-1-yl)-5-(trifluoromethyl)aniline

3-(3-methylpiperidin-1-yl)-5-(trifluoromethyl)aniline

Formula: C13H17F3N2

SMILES: CC1CCCN(C1)C1=CC(=CC(N)=C1)C(F)(F)F

IUPAC: 3-(3-methylpiperidin-1-yl)-5-(trifluoromethyl)aniline

InChI: InChI=1/C13H17F3N2/c1-9-3-2-4-18(8-9)12-6-10(13(14,15)16)5-11(17)7-12/h5-7,9H,2-4,8,17H2,1H3

Composition: C (60.45%), H (6.63%), F (22.07%), N (10.85%)

Molar Mass: 258.288

Atom Count: 35

Heavy Atom Count: 18

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 1
Exact Mass 258.134383044
Formal Charge 0
FSP3 0.54
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey TWARMSUKHAGDJO-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 67.77
Topological Polar Surface Area 29.26
Polarizability 23.97
Ring Count 2
Rotatable Bond Count 2

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Struchem co.,ltd
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Purity LeadTime Formula PacketSize UnitPrice
95% <5 Days C13H17F3N2 $1,220.00-$2,060.00$1,220.00$1,700.00$2,060.00
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