Text Search
Structure Search

tert-butyl (1S,5R)-1-methyl-6-oxo-3-azabicyclo[3.2.0]heptane-3-carboxylate

tert-butyl (1S,5R)-1-methyl-6-oxo-3-azabicyclo[3.2.0]heptane-3-carboxylate

CAS: 1263378-57-9

Formula: C12H19NO3

SMILES: CC(C)(C)OC(=O)N1C[C@@H]2C(=O)C[C@]2(C)C1

IUPAC: tert-butyl (1S,5R)-1-methyl-6-oxo-3-azabicyclo[3.2.0]heptane-3-carboxylate

InChI: InChI=1S/C12H19NO3/c1-11(2,3)16-10(15)13-6-8-9(14)5-12(8,4)7-13/h8H,5-7H2,1-4H3/t8-,12-/m1/s1

Composition: C (63.98%), H (8.50%), N (6.22%), O (21.30%)

Molar Mass: 225.288

Atom Count: 35

Heavy Atom Count: 16

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 2
Exact Mass 225.136493476
Formal Charge 0
FSP3 0.83
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 0
InChIKey ZHAYAUIMRPDSNP-PRHODGIISA-N
Lipinski's Rule of Five 1
Molar Refractivity 59.36
Topological Polar Surface Area 46.61
Polarizability 23.38
Ring Count 2
Rotatable Bond Count 2

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
J&W PHARMLAB LLC
Purity LeadTime CAS PacketSize UnitPrice
98% <2 Days 1263378-57-9 $221.95-$6,762.00$221.95$327.75$540.50$966.00$1,817.00$6,762.00
Request Quote