(S)-tert-butyl 1-oxobutan-2-ylcarbamate

Base Information

Chemical Name:(S)-tert-butyl 1-oxobutan-2-ylcarbamate
CAS No.:153371-25-6
Molecular Formula:C9H17 N O3
Molecular Weight:187.239
Hs Code.:
European Community (EC) Number:873-025-5
Nikkaji Number:J1.334.017J
Pharos Ligand ID:UQ2GVPN42VB7
ChEMBL ID:CHEMBL93420
Mol file:153371-25-6.mol

Synonyms:153371-25-6;(S)-tert-butyl 1-oxobutan-2-ylcarbamate;Carbamic acid, [(1S)-1-formylpropyl]-, 1,1-dimethylethyl ester (9CI);TERT-BUTYL N-[(2S)-1-OXOBUTAN-2-YL]CARBAMATE;CHEMBL93420;Carbamic acid, [(1S)-1-formylpropyl]-, 1,1-dimethylethyl ester;tert-Butyl (S)-(1-oxobutan-2-yl)carbamate;SCHEMBL374867;NBDAUFXJXMBQRC-ZETCQYMHSA-N;BDBM50137788;2(S)-tert-butoxycarbonylaminobutyraldehyde;(2S)-2-(tert-Butoxycarbonylamino)butanal;tert-Butyl[(1S)-1-formylpropyl]carbamate;tert-butyl [(1S)-1-formylpropyl]carbamate;2(S)-(tert-butoxycarbonyl)aminobutyraldehyde;(S)-2-(tert-butoxycarbonyl)aminobutyraldehyde;2(S)-(tert-butoxycarbonyl)amino-butyraldehyde;EN300-170440;1,1-dimethylethyl [(1S)-1-formylpropyl]carbamate;((S)-1-Formyl-propyl)-carbamic acid tert-butyl ester;(S)-(1-formyl-propyl)-carbamic acid tert-butyl ester;Carbamic Acid,[(1S)-1-Formylpropyl]-,1,1-Dimethylethyl Ester

Suppliers and Price of (S)-tert-butyl 1-oxobutan-2-ylcarbamate

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

TRC
1,1-Dimethylethyl[(1S)-1-Formylpropyl]carbamate
10mg
$ 45.00

Total 4 raw suppliers

Chemical Property of (S)-tert-butyl 1-oxobutan-2-ylcarbamate

Chemical Property:

Melting Point:44 °C
Boiling Point:266.5±23.0 °C(Predicted)
PKA:11.43±0.46(Predicted)
PSA：55.40000
Density:1.000±0.06 g/cm3(Predicted)
LogP:1.87950
XLogP3:1.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:5
Exact Mass:187.12084340
Heavy Atom Count:13
Complexity:184

Purity/Quality:

95% ^*data from raw suppliers

1,1-Dimethylethyl[(1S)-1-Formylpropyl]carbamate ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCC(C=O)NC(=O)OC(C)(C)C
Isomeric SMILES:CC[C@@H](C=O)NC(=O)OC(C)(C)C

Technology Process of (S)-tert-butyl 1-oxobutan-2-ylcarbamate

There total 7 articles about (S)-tert-butyl 1-oxobutan-2-ylcarbamate 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: 100.0%

: 150736-72-4
(S)-tert-butyl 1-hydroxybutan-2-ylcarbamate

: 153371-25-6
(2S)-2-(tert-butoxycarbonyl)aminobutyraldehyde

Guidance literature:: (S)-tert-butyl 1-hydroxybutan-2-ylcarbamate; With oxalyl dichloride; triethylamine; In dichloromethane; dimethyl sulfoxide; at -70 - -40 ℃; for 0.166667h; Inert atmosphere;

With triethylamine; In dichloromethane; dimethyl sulfoxide; at -70 - 20 ℃; for 2h;

Reference yield: 77.0%

: 7681-52-9
sodium hypochlorite

: 150736-72-4
(S)-tert-butyl 1-hydroxybutan-2-ylcarbamate

: 153371-25-6
(2S)-2-(tert-butoxycarbonyl)aminobutyraldehyde

Guidance literature:: (S)-tert-butyl 1-hydroxybutan-2-ylcarbamate; With 2,2,6,6-Tetramethyl-1-piperidinyloxy free radical; sodium hydrogencarbonate; sodium bromide; In dichloromethane; water; at 0 - 20 ℃;

sodium hypochlorite; In dichloromethane; water; at 0 ℃; for 1.16667h;