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3-[1-(3-cyclohexyl-3-hydroxypropyl)-3,4-dimethylpiperidin-4-yl]phenol

3-[1-(3-cyclohexyl-3-hydroxypropyl)-3,4-dimethylpiperidin-4-yl]phenol

CAS: 119193-09-8

Formula: C22H35NO2

SMILES: CC1CN(CCC(O)C2CCCCC2)CCC1(C)C1=CC=CC(O)=C1

IUPAC: 3-[1-(3-cyclohexyl-3-hydroxypropyl)-3,4-dimethylpiperidin-4-yl]phenol

InChI: InChI=1/C22H35NO2/c1-17-16-23(13-11-21(25)18-7-4-3-5-8-18)14-12-22(17,2)19-9-6-10-20(24)15-19/h6,9-10,15,17-18,21,24-25H,3-5,7-8,11-14,16H2,1-2H3

Composition: C (76.48%), H (10.21%), N (4.05%), O (9.26%)

Molar Mass: 345.527

Atom Count: 60

Heavy Atom Count: 25

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 3
Exact Mass 345.266779371
Formal Charge 0
FSP3 0.73
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 2
InChIKey LVVHEFJXPXAUDD-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 104.27
Topological Polar Surface Area 43.7
Polarizability 41.02
Ring Count 3
Rotatable Bond Count 5

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Purity LeadTime CAS PacketSize UnitPrice
95% <2 Days 119193-09-8 $306.99-$901.31$306.99$306.99$393.30$393.30$901.31
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