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tert-butyl N-{3-cyanobicyclo[1.1.1]pentan-1-yl}carbamate

tert-butyl N-{3-cyanobicyclo[1.1.1]pentan-1-yl}carbamate

CAS: 2170371-89-6

Formula: C11H16N2O2

SMILES: CC(C)(C)OC(=O)NC12CC(C1)(C2)C#N

IUPAC: tert-butyl N-{3-cyanobicyclo[1.1.1]pentan-1-yl}carbamate

InChI: InChI=1S/C11H16N2O2/c1-9(2,3)15-8(14)13-11-4-10(5-11,6-11)7-12/h4-6H2,1-3H3,(H,13,14)

Composition: C (63.44%), H (7.74%), N (13.45%), O (15.36%)

Molar Mass: 208.261

Atom Count: 31

Heavy Atom Count: 15

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 0
Exact Mass 208.121177763
Formal Charge 0
FSP3 0.82
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey KSXWAPXMULDENR-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 54.48
Topological Polar Surface Area 62.12
Polarizability 21.31
Ring Count 2
Rotatable Bond Count 3

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Purity LeadTime CAS PacketSize UnitPrice
95% 1 Day 2170371-89-6 $442.26-$1,651.10$442.26$825.55$1,651.10
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