Text Search
Structure Search

tert-butyl 2-fluoro-3-oxo-8-azabicyclo[3.2.1]octane-8-carboxylate

tert-butyl 2-fluoro-3-oxo-8-azabicyclo[3.2.1]octane-8-carboxylate

CAS: 1404196-37-7

Formula: C12H18FNO3

SMILES: CC(C)(C)OC(=O)N1C2CCC1C(F)C(=O)C2

IUPAC: tert-butyl 2-fluoro-3-oxo-8-azabicyclo[3.2.1]octane-8-carboxylate

InChI: InChI=1/C12H18FNO3/c1-12(2,3)17-11(16)14-7-4-5-8(14)10(13)9(15)6-7/h7-8,10H,4-6H2,1-3H3

Composition: C (59.25%), H (7.46%), F (7.81%), N (5.76%), O (19.73%)

Molar Mass: 243.278

Atom Count: 35

Heavy Atom Count: 17

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 3
Exact Mass 243.127071607
Formal Charge 0
FSP3 0.83
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 0
InChIKey YYCAGVRICFXYHB-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 58.69
Topological Polar Surface Area 46.61
Polarizability 23.16
Ring Count 2
Rotatable Bond Count 2

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
| Clear Filters
Molecule Market Select
Purity LeadTime CAS UnitPrice
98% <10 Days 1404196-37-7 Quote Only
Request Quote
Shanghai AQ BioPharma Co., Ltd.
Supplier Profile
Purity LeadTime CAS PacketSize UnitPrice
95% <8 Days 1404196-37-7 $97.14-$1,398.86$97.14$291.43$466.29$874.29$1,398.86
Request Quote
J&W PHARMLAB LLC
Supplier Profile
Purity LeadTime CAS PacketSize UnitPrice
97% <2 Days 1404196-37-7 $124.20-$917.70$124.20$126.50$143.75$171.35$227.70$917.70
Request Quote