(S)-Tetrahydro-2H-pyran-2-carboxylic acid

Base Information

Chemical Name:(S)-Tetrahydro-2H-pyran-2-carboxylic acid
CAS No.:105499-32-9
Molecular Formula:C6H10O3
Molecular Weight:130.144
Hs Code.:
European Community (EC) Number:850-113-1
DSSTox Substance ID:DTXSID20501428
Nikkaji Number:J3.193.275K
Wikidata:Q82353789
Mol file:105499-32-9.mol

Synonyms:105499-32-9;(S)-Tetrahydro-2H-pyran-2-carboxylic acid;(2S)-Oxane-2-carboxylic acid;2H-Pyran-2-carboxylic acid, tetrahydro-, (S)-;MFCD18909424;SCHEMBL8086969;DTXSID20501428;AMY34469;AKOS016844291;(2S)-Tetrahydropyran-2-Carboxylic Acid;AS-82091;TS-01703;(S)-Tetrahydro-2H-pyran-2-carboxylicacid;CS-0053085;P15808

Suppliers and Price of (S)-Tetrahydro-2H-pyran-2-carboxylic acid

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
(2S)-Oxane-2-carboxylicAcid
50mg
$ 175.00

Chemenu
(S)-tetrahydro-2H-Pyran-2-carboxylicacid 97%
1g
$ 715.00

AK Scientific
(S)-Tetrahydro-2H-pyran-2-carboxylicacid
1g
$ 390.00

ACHEMBLOCK
(2S)-oxane-2-carboxylicacid 97%
250MG
$ 250.00

Total 16 raw suppliers

Chemical Property of (S)-Tetrahydro-2H-pyran-2-carboxylic acid

Chemical Property:

Boiling Point:264.5±33.0 °C(Predicted)
PKA:3.70±0.20(Predicted)
PSA：46.53000
Density:1.185±0.06 g/cm3(Predicted)
LogP:0.64010
XLogP3:0.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:130.062994177
Heavy Atom Count:9
Complexity:111

Purity/Quality:

99%, ^*data from raw suppliers

(2S)-Oxane-2-carboxylicAcid ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1CCOC(C1)C(=O)O
Isomeric SMILES:C1CCO[C@@H](C1)C(=O)O

Technology Process of (S)-Tetrahydro-2H-pyran-2-carboxylic acid

There total 8 articles about (S)-Tetrahydro-2H-pyran-2-carboxylic acid 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: 96.0%

: 31518-14-6
3,4-dihydro-2H-pyran-6-carboxylic acid

: 105499-32-9
(S)-(-)-Tetrahydropyran-2-carboxylic Acid

Guidance literature:: With C₆₃H₇₈IrNOP⁽²⁺⁾*C₃₂H₁₂BF₂₄^(1-); hydrogen; caesium carbonate; In methanol; at 60 ℃; for 12h; under 4560.31 Torr; enantioselective reaction; Autoclave;
DOI:10.1002/anie.201301341

Reference yield:

: (S)-4-benzyl-3-((S)-tetrahydro-2H-pyran-2-carbonyl)oxazolidin-2-one

: 105499-32-9
(S)-(-)-Tetrahydropyran-2-carboxylic Acid

Guidance literature:: With water; dihydrogen peroxide; lithium hydroxide; In tetrahydrofuran; at 0 - 5 ℃; for 1.5h;

Reference yield:

: 56660-59-4
2,3-dibromotetrahydropyran

: 105499-32-9
(S)-(-)-Tetrahydropyran-2-carboxylic Acid

Guidance literature:: Multi-step reaction with 4 steps

1: tetrachloromethane / 16 h / Reflux

2: piperidine / 60.5 h / 20 - 30 °C

3: potassium hydroxide / water / 12 h

4: caesium carbonate; hydrogen; C₆₃H₇₈IrNOP⁽²⁺⁾*C₃₂H₁₂BF₂₄^(1-) / methanol / 12 h / 60 °C / 4560.31 Torr / Autoclave

With piperidine; C₆₃H₇₈IrNOP⁽²⁺⁾*C₃₂H₁₂BF₂₄^(1-); hydrogen; caesium carbonate; potassium hydroxide; In methanol; tetrachloromethane; water;
DOI:10.1002/anie.201301341