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tert-butyl (4aR,7aR)-octahydropyrrolo[3,4-b]morpholine-6-carboxylate - 97%, high purity , CAS No.1383428-22-5

    Grade & Purity:
  • ≥97%
In stock
Item Number
T628783
Grouped product items
SKU Size
Availability
Price Qty
T628783-100mg
100mg
Available within 8-12 weeks(?)
Production requires sourcing of materials. We appreciate your patience and understanding.
$218.90
T628783-250mg
250mg
Available within 8-12 weeks(?)
Production requires sourcing of materials. We appreciate your patience and understanding.
$349.90
T628783-500mg
500mg
Available within 8-12 weeks(?)
Production requires sourcing of materials. We appreciate your patience and understanding.
$581.90
T628783-1g
1g
Available within 8-12 weeks(?)
Production requires sourcing of materials. We appreciate your patience and understanding.
$1,048.90

Basic Description

Synonyms 138026-93-4 | trans-tert-Butyl hexahydropyrrolo[3,4-b][1,4]oxazine-6(2H)-carboxylate | 1383428-22-5 | Racemic trans-hexahydro-pyrrolo[3,4-b][1,4]oxazine-6-carboxylic acid tert-butyl ester | (4aR,7aR)-tert-Butyl hexahydropyrrolo[3,4-b][1,4]oxazine-6(2H)-ca
Specifications & Purity ≥97%
Shipped In Normal

Names and Identifiers

IUPAC Name tert-butyl (4aR,7aR)-3,4,4a,5,7,7a-hexahydro-2H-pyrrolo[3,4-b][1,4]oxazine-6-carboxylate
INCHI InChI=1S/C11H20N2O3/c1-11(2,3)16-10(14)13-6-8-9(7-13)15-5-4-12-8/h8-9,12H,4-7H2,1-3H3/t8-,9-/m1/s1
InChIKey AUXXIKSVHUSTOA-RKDXNWHRSA-N
Smiles CC(C)(C)OC(=O)N1CC2C(C1)OCCN2
Isomeric SMILES CC(C)(C)OC(=O)N1C[C@@H]2[C@@H](C1)OCCN2
PubChem CID 67991858
Molecular Weight 228.29

Certificates(CoA,COO,BSE/TSE and Analysis Chart)

C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:

Chemical and Physical Properties

Molecular Weight 228.290 g/mol
XLogP3 0.200
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 2
Exact Mass 228.147 Da
Monoisotopic Mass 228.147 Da
Topological Polar Surface Area 50.800 Ų
Heavy Atom Count 16
Formal Charge 0
Complexity 275.000
Isotope Atom Count 0
Defined Atom Stereocenter Count 2
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
The total count of all stereochemical bonds 0
Covalently-Bonded Unit Count 1

Solution Calculators

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