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tert-butyl N-(4-oxocyclohex-2-en-1-yl)carbamate

tert-butyl N-(4-oxocyclohex-2-en-1-yl)carbamate

CAS: 205877-92-5

Formula: C11H17NO3

SMILES: CC(C)(C)OC(=O)NC1CCC(=O)C=C1

IUPAC: tert-butyl N-(4-oxocyclohex-2-en-1-yl)carbamate

InChI: InChI=1/C11H17NO3/c1-11(2,3)15-10(14)12-8-4-6-9(13)7-5-8/h4,6,8H,5,7H2,1-3H3,(H,12,14)

Composition: C (62.54%), H (8.11%), N (6.63%), O (22.72%)

Molar Mass: 211.261

Atom Count: 32

Heavy Atom Count: 15

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 1
Exact Mass 211.120843411
Formal Charge 0
FSP3 0.64
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey QGAMBGGFAOFTCM-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 57.39
Topological Polar Surface Area 55.4
Polarizability 22.02
Ring Count 1
Rotatable Bond Count 3

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Purity LeadTime CAS PacketSize UnitPrice
95% 1 Day 205877-92-5 $383.29-$1,474.20$383.29$737.10$1,474.20
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