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tert-butyl (1S,2S)-2-(aminomethyl)cyclohexane-1-carboxylate

tert-butyl (1S,2S)-2-(aminomethyl)cyclohexane-1-carboxylate

Formula: C12H23NO2

SMILES: CC(C)(C)OC(=O)[C@H]1CCCC[C@@H]1CN

IUPAC: tert-butyl (1S,2S)-2-(aminomethyl)cyclohexane-1-carboxylate

InChI: InChI=1S/C12H23NO2/c1-12(2,3)15-11(14)10-7-5-4-6-9(10)8-13/h9-10H,4-8,13H2,1-3H3/t9-,10+/m1/s1

Composition: C (67.57%), H (10.87%), N (6.57%), O (15.00%)

Molar Mass: 213.321

Atom Count: 38

Heavy Atom Count: 15

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 2
Exact Mass 213.172878985
Formal Charge 0
FSP3 0.92
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey QKPRNENUGIJRRL-ZJUUUORDSA-N
Lipinski's Rule of Five 1
Molar Refractivity 60.48
Topological Polar Surface Area 52.32
Polarizability 24.39
Ring Count 1
Rotatable Bond Count 4

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
J&W PHARMLAB LLC
Purity LeadTime Formula PacketSize UnitPrice
97% <2 Days C12H23NO2 $299.00-$5,612.00$299.00$483.00$851.00$1,587.00$5,612.00
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