(S)-Tert-butyl but-3-YN-2-ylcarbamate

Base Information

Chemical Name:(S)-Tert-butyl but-3-YN-2-ylcarbamate
CAS No.:118080-79-8
Molecular Formula:C₉H₁₅NO₂
Molecular Weight:169.224
Hs Code.:
DSSTox Substance ID:DTXSID30450791
Nikkaji Number:J2.066.381B
Wikidata:Q82270610
Mol file:118080-79-8.mol

Synonyms:118080-79-8;(S)-TERT-BUTYL BUT-3-YN-2-YLCARBAMATE;(S)-(1-METHYL-PROP-2-YNYL)-CARBAMIC ACID TERT-BUTYL ESTER;tert-butyl N-[(2S)-but-3-yn-2-yl]carbamate;tert-butyl (2S)-but-3-yn-2-ylcarbamate;(S)-N-Boc-3-amino-1-butyne;SCHEMBL1106536;DTXSID30450791;AMWSEGBTTPQUKW-ZETCQYMHSA-N;MFCD18835704;Carbamic acid, [(1S)-1-methyl-2-propynyl]-, 1,1-dimethylethyl ester (9CI);AC-29590;AS-42712;CS-0158583;(S)-TERT-BUTYLBUT-3-YN-2-YLCARBAMATE;A893218;tert-butyl [(1S)-1-methylprop-2-yn-1-yl]carbamate;[(S)-1-Methyl-2-propynyl]carbamic acid tert-butyl ester

Suppliers and Price of (S)-Tert-butyl but-3-YN-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
(S)-N-Boc-3-amino-1-butyne
250mg
$ 1320.00

J&W Pharmlab
(S)-(1-Methyl-prop-2-ynyl)-carbamicacidtert-butylester 97%
1g
$ 549.00

J&W Pharmlab
(S)-(1-Methyl-prop-2-ynyl)-carbamicacidtert-butylester 97%
5g
$ 1998.00

J&W Pharmlab
(S)-(1-Methyl-prop-2-ynyl)-carbamicacidtert-butylester 97%
250mg
$ 212.00

J&W Pharmlab
(S)-(1-Methyl-prop-2-ynyl)-carbamicacidtert-butylester 97%
50mg
$ 133.00

J&W Pharmlab
(S)-(1-Methyl-prop-2-ynyl)-carbamicacidtert-butylester 97%
100mg
$ 156.00

J&W Pharmlab
(S)-(1-Methyl-prop-2-ynyl)-carbamicacidtert-butylester 97%
500mg
$ 325.00

Crysdot
(S)-tert-Butylbut-3-yn-2-ylcarbamate 97%
1g
$ 442.00

Biosynth Carbosynth
(S)-N-Boc-3-amino-1-butyne
250 mg
$ 1640.00

Biosynth Carbosynth
(S)-N-Boc-3-amino-1-butyne
100 mg
$ 901.00

Total 12 raw suppliers

Chemical Property of (S)-Tert-butyl but-3-YN-2-ylcarbamate

Chemical Property:

PSA：41.82000
LogP:1.73720
Storage Temp.:2-8°C
XLogP3:1.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:3
Exact Mass:169.110278721
Heavy Atom Count:12
Complexity:206

Purity/Quality:

97% ^*data from raw suppliers

(S)-N-Boc-3-amino-1-butyne ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC(C#C)NC(=O)OC(C)(C)C
Isomeric SMILES:C[C@@H](C#C)NC(=O)OC(C)(C)C
Uses The S-enantiomer of N-Boc-3-amino-1-butyne (B601600).

Technology Process of (S)-Tert-butyl but-3-YN-2-ylcarbamate

There total 15 articles about (S)-Tert-butyl but-3-YN-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: 97.0%

: 79069-50-4
Boc-Ala-H

: 90965-06-3
dimethyl 1-(1-diazo-2-oxopropyl)phosphonate

: 118080-82-3,118080-79-8
(S)-1-methyl-N-(t-butoxycarbonyl)-2-propynamine

Guidance literature:: With potassium carbonate; In methanol; at 20 ℃; for 1h; Inert atmosphere;
DOI:10.1002/cmdc.202000793

Reference yield: 85.0%

: 176962-17-7,873009-27-9
((S)-3,3-Dibromo-1-methyl-allyl)-carbamic acid tert-butyl ester

: 118080-82-3,118080-79-8
(S)-1-methyl-N-(t-butoxycarbonyl)-2-propynamine

Guidance literature:: ((S)-3,3-Dibromo-1-methyl-allyl)-carbamic acid tert-butyl ester; With n-butyllithium; In tetrahydrofuran; hexanes; at -78 ℃; for 1h;

With sodium hydroxide; water; In tetrahydrofuran; hexanes; at -78 - 20 ℃;

Reference yield: 77.0%

: 90965-06-3
dimethyl 1-(1-diazo-2-oxopropyl)phosphonate

: 146553-06-2,87694-49-3
tert-butyl {(S)-1-[methoxy(methyl)amino]-1-oxopropan-2-yl}carbamate

: 118080-82-3,118080-79-8
(S)-1-methyl-N-(t-butoxycarbonyl)-2-propynamine

Guidance literature:: tert-butyl {(S)-1-[methoxy(methyl)amino]-1-oxopropan-2-yl}carbamate; With diisobutylaluminium hydride; In n-heptane; dichloromethane; at -78 ℃;

dimethyl 1-(1-diazo-2-oxopropyl)phosphonate; With potassium carbonate; In methanol; n-heptane; dichloromethane; at 20 ℃; Further stages.;
DOI:10.1016/j.tetlet.2004.05.139