Menthyl borate

Base Information

Chemical Name:Menthyl borate
CAS No.:21105-05-5
Deprecated CAS:103799-70-8,19013-38-8
Molecular Formula:C30H57BO3
Molecular Weight:476.592
Hs Code.:
European Community (EC) Number:263-701-2
UNII:Q9A4FNB1ZQ
Wikidata:Q27287144

Synonyms:Menthyl borate;p-Menth-3-yl borate;Q9A4FNB1ZQ;Menthol, triester with boric acid (H3BO3);EINECS 211-229-2;EINECS 263-701-2;62697-74-9;rel-Tris((1R,2S,5R)-2-isopropyl-5-methylcyclohexyl) borate;Cyclohexanol, 5-methyl-2-(1-methylethyl)-, 1,1',1''-triester with boric acid (H3BO3), (1R,1'R,1''R,2S,2'S,2''S,5R,5'R,5''R)-rel-;C30H57BO3;C30-H57-B-O3;Cyclohexanol, 5-methyl-2-(1-methylethyl)-, triester with boric acid (H3BO3);Cyclohexanol, 5-methyl-2-(1-methylethyl)-, triester with boric acid (H3BO3), (1R,1'R,1''R,2S,2'S,2''S,5R,5'R,5''R)-rel-;starbld0016599;UNII-Q9A4FNB1ZQ;MENTHYL BORATE [MI];MENTHYL BORATE, (-)-;Cyclohexanol, 5-methyl-2-(1-methylethyl)-, triester with boric acid(H3BO3);Cyclohexanol, 5-methyl-2-(1-methylethyl)-, triester with boric acid(H3BO3), stereoisomer;Cyclohexanol, 5-methyl-2-(1-methylethyl)-, triester with boric acid(H3BO3), (1R,2S,5R)-rel-;EINECS 244-212-3;Q27287144;MENTHOL, TRIESTER WITH BORIC ACID (H3BO3), (-)-;5-Methyl-2-(1-methylethyl)cyclohexanol, triester with boric acid (H3BO3), stereoisomer;5-Methyl-2-(1-methylethyl)cyclohexanol, triester with boris acid (H3BO3), stereoisomer;Cyclohexanol, 5-methyl-2-(1-methylethyl)-, 1,1',1''-triester with boric acid (H3BO3);CYCLOHEXANOL, 5-METHYL-2-(1-METHYLETHYL)-, TRIESTER WITH BORIC ACID (H3BO3), (1R,1'R,1''R,2S,2'S,2''S,5R,5'R,5''R)-

Suppliers and Price of Menthyl borate

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

Sigma-Aldrich
(-)-TRIMENTHYL BORATE Aldrich
250mg
$ 55.10

American Custom Chemicals Corporation
(-)-TRIMENTHYL BORATE 95.00%
5MG
$ 502.14

Total 5 raw suppliers

Chemical Property of Menthyl borate

Chemical Property:

PSA：27.69000
LogP:8.40350
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:9
Exact Mass:476.4400758
Heavy Atom Count:34
Complexity:513

Purity/Quality:

99% ^*data from raw suppliers

(-)-TRIMENTHYL BORATE Aldrich ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:B(OC1CC(CCC1C(C)C)C)(OC2CC(CCC2C(C)C)C)OC3CC(CCC3C(C)C)C
Isomeric SMILES:B(O[C@@H]1C[C@@H](CC[C@H]1C(C)C)C)(O[C@@H]2C[C@@H](CC[C@H]2C(C)C)C)O[C@@H]3C[C@@H](CC[C@H]3C(C)C)C

Technology Process of Menthyl borate

There total 2 articles about Menthyl borate 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: 62.1%

: 5187-37-1
tetraacetyl diborate

: 2216-51-5
(-)-menthol

: 21105-05-5,97996-39-9
(1R,2S,5R)-2-isopropyl-5-methylcyclohexyl bis((1S,2S,5R)-2-isopropyl-5-methylcyclohexyl) borate (trimenthyl borate)

Guidance literature:: at 120 ℃; for 0.416667h;
DOI:10.1002/anie.201208755

Reference yield:

: 2216-51-5
(-)-menthol

: 21105-05-5,97996-39-9
(1R,2S,5R)-2-isopropyl-5-methylcyclohexyl bis((1S,2S,5R)-2-isopropyl-5-methylcyclohexyl) borate (trimenthyl borate)

Guidance literature:: With boric acid; toluene;
DOI:10.1021/ja01611a052

Reference yield: 37.0%

: 21105-05-5,97996-39-9
(1R,2S,5R)-2-isopropyl-5-methylcyclohexyl bis((1S,2S,5R)-2-isopropyl-5-methylcyclohexyl) borate (trimenthyl borate)

: 52509-81-6
potassium 4-methoxybenzoate

: 1-(((1R,2S,5R)-2-isopropyl-5-methylcyclohexyl)oxy)-3-methoxybenzene(1-menthyloxy-3-methoxybenzene)

Guidance literature:: With oxygen; copper diacetate; silver carbonate; In N,N-dimethyl-formamide; at 140 ℃; for 36h; under 760.051 Torr;
DOI:10.1002/anie.201208755