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tert-butyl 2-(benzylamino)-7-azaspiro[3.5]nonane-7-carboxylate

tert-butyl 2-(benzylamino)-7-azaspiro[3.5]nonane-7-carboxylate

CAS: 1352925-74-6

Formula: C20H30N2O2

SMILES: CC(C)(C)OC(=O)N1CCC2(CC(C2)NCC2=CC=CC=C2)CC1

IUPAC: tert-butyl 2-(benzylamino)-7-azaspiro[3.5]nonane-7-carboxylate

InChI: InChI=1S/C20H30N2O2/c1-19(2,3)24-18(23)22-11-9-20(10-12-22)13-17(14-20)21-15-16-7-5-4-6-8-16/h4-8,17,21H,9-15H2,1-3H3

Composition: C (72.69%), H (9.15%), N (8.48%), O (9.68%)

Molar Mass: 330.472

Atom Count: 54

Heavy Atom Count: 24

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 330.230728214
Formal Charge 0
FSP3 0.65
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey ZDJCRZYKHSXQLV-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 96.37
Topological Polar Surface Area 41.57
Polarizability 38.08
Ring Count 3
Rotatable Bond Count 5

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Purity LeadTime CAS PacketSize UnitPrice
95% <5 Days 1352925-74-6 $1,060.00-$5,320.00$1,060.00$3,240.00$5,320.00
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