(3aS,4S,6aR)-tert-butyl 4-formyl-2,2-dimethyldihydro-3aH-[1,3]dioxolo[4,5-c]pyrrole-5(4H)-carboxylate

Base Information

Chemical Name:(3aS,4S,6aR)-tert-butyl 4-formyl-2,2-dimethyldihydro-3aH-[1,3]dioxolo[4,5-c]pyrrole-5(4H)-carboxylate
CAS No.:127910-61-6
Molecular Formula:C13H21NO5
Molecular Weight:271.313
Hs Code.:
DSSTox Substance ID:DTXSID701110746
Mol file:127910-61-6.mol

Synonyms:127910-61-6;(3aS,4S,6aR)-tert-butyl 4-formyl-2,2-dimethyldihydro-3aH-[1,3]dioxolo[4,5-c]pyrrole-5(4H)-carboxylate;Tert-butyl (3aS,4S,6aR)-4-formyl-2,2-dimethyl-3a,4,6,6a-tetrahydro-[1,3]dioxolo[4,5-c]pyrrole-5-carboxylate;5H-1,3-Dioxolo[4,5-c]pyrrole-5-carboxylic acid,4-formyltetrahydro-2,2-dimethyl-, 1,1-dimethylethyl ester,[3aS-(3aa,4b,6aa)]-;DTXSID701110746;PS-2003;1,1-Dimethylethyl (3aS,4S,6aR)-4-formyltetrahydro-2,2-dimethyl-5H-1,3-dioxolo[4,5-c]pyrrole-5-carboxylate

Suppliers and Price of (3aS,4S,6aR)-tert-butyl 4-formyl-2,2-dimethyldihydro-3aH-[1,3]dioxolo[4,5-c]pyrrole-5(4H)-carboxylate

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

Matrix Scientific
(3AS,4S,6aR)-tert-Butyl 4-formyl-2,2-dimethyldihydro-3aH-[1,3]dioxolo[4,5-c]pyrrole-5(4H)-carboxylate >97%
50mg
$ 720.00

AK Scientific
(3AS,4S,6aR)-tert-Butyl4-formyl-2,2-dimethyldihydro-3aH-[1,3]dioxolo[4,5-c]pyrrole-5(4H)-carboxylate
50mg
$ 1022.00

AK Scientific
(3AS,4S,6aR)-tert-Butyl4-formyl-2,2-dimethyldihydro-3aH-[1,3]dioxolo[4,5-c]pyrrole-5(4H)-carboxylate
5mg
$ 317.00

Total 1 raw suppliers

Chemical Property of (3aS,4S,6aR)-tert-butyl 4-formyl-2,2-dimethyldihydro-3aH-[1,3]dioxolo[4,5-c]pyrrole-5(4H)-carboxylate

Chemical Property:

PSA：65.07000
LogP:1.26260
XLogP3:0.8
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:3
Exact Mass:271.14197277
Heavy Atom Count:19
Complexity:387

Purity/Quality:: (3AS,4S,6aR)-tert-Butyl 4-formyl-2,2-dimethyldihydro-3aH-[1,3]dioxolo[4,5-c]pyrrole-5(4H)-carboxylate >97% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC1(OC2CN(C(C2O1)C=O)C(=O)OC(C)(C)C)C
Isomeric SMILES:CC1(O[C@@H]2CN([C@@H]([C@@H]2O1)C=O)C(=O)OC(C)(C)C)C

Technology Process of (3aS,4S,6aR)-tert-butyl 4-formyl-2,2-dimethyldihydro-3aH-[1,3]dioxolo[4,5-c]pyrrole-5(4H)-carboxylate

There total 19 articles about (3aS,4S,6aR)-tert-butyl 4-formyl-2,2-dimethyldihydro-3aH-[1,3]dioxolo[4,5-c]pyrrole-5(4H)-carboxylate which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 93.0%

: 127811-92-1
tert-butyl (1R,5S,6S)-6-(1,3-dithian-2-yl)-3,3-dimethyl-2,4-dioxa-7-azabicyclo<3.3.0>octane-7-carboxylate

: 127910-61-6
(1R,5S,6S)-tert-butyl 6-formyl-3,3-dimethyl-2,4-dioxa-7-azabicyclo<3.3.0>octane-7-carboxylate

Guidance literature:: With thallium(III) trifluoroacetate; In diethyl ether; water; for 12h; Ambient temperature;

Reference yield: 88.0%

: 100806-49-3
(3aS,4R,6aR)-4-hydroxymethyl-2,2-dimethyl-tetrahydro-1,3-dioxolo[4,5-c]pyrrole-5-carboxylic acid tert-butyl ester

: 127910-61-6
(1R,5S,6S)-tert-butyl 6-formyl-3,3-dimethyl-2,4-dioxa-7-azabicyclo<3.3.0>octane-7-carboxylate

Guidance literature:: With N-methyl-2-indolinone; tetrapropylammonium perruthennate; 4 A molecular sieve; In dichloromethane;
DOI:10.1055/s-2006-939710

Reference yield:

: 24424-99-5
di-tert-butyl dicarbonate

: 127910-61-6
(1R,5S,6S)-tert-butyl 6-formyl-3,3-dimethyl-2,4-dioxa-7-azabicyclo<3.3.0>octane-7-carboxylate

Guidance literature:: Multi-step reaction with 2 steps

1: 91 percent / triethylamine / CH₂Cl₂ / 12 h

2: 93 percent / thallium(III) trifluoroacetate / diethyl ether; H₂O / 12 h / Ambient temperature

With triethylamine; thallium(III) trifluoroacetate; In diethyl ether; dichloromethane; water;