- Menthyl acetate
- Menthyl acetoacetate
- Menthyl anthranilate
- Menthyl formate
- Menthyl isovalerate
- Menthyl lactate
- Menthyl N-(3-triethoxysilylpropyl)carbamate
- 1641-09-43-Thiophenecarbonitrile
- 164112-72-5Benzene-d5,(trifluoromethyl)- (9CI)
- 1641-17-4Methanone,(2-hydroxy-4-methoxyphenyl)(4-methylphenyl)-
- 164119-81-71H-Indole-3-methanamine,N,N,4-trimethyl-
- 164124-35-0Benz[f]azulen-2(3H)-one,4,9-bis(acetyloxy)-3a,4,4a,5,6,7,8,8a,9,10-decahydro-6,10-dihydroxy-3a-(1-hydroxy-1-methylethyl)-1,8a-dimethyl-5-methylene-,(3aR,4S,4aR,6S,8aR,9R,10R)- (9CI)
- 164124-48-55H-Furo[2',3':4,5]azuleno[5,6-b]furan-5,11(6H)-dione,decahydro-7-hydroxy-6a,8a-dimethyl-3-methylene-9-(1-methylethyl)-,(3aR,6aR,7S,8aS,9S,11aR,11bR)-
- 16412-54-7Phenol,3-[2-[(dimethylamino)methyl]-1-hydroxycyclohexyl]-, hydrochloride (1:1)
- 16413-26-6Benzonitrile,3-isocyanato-
- 1641-40-31,3,2-Benzodioxaphosphole,2-chloro-
- 16414-34-9Benzaldehyde,3-bromo-4,5-dihydroxy-
Hot Products
- 104987-11-3Tacrolimus
- 141-53-7Sodium formate
- 8001-54-5Quaternary ammonium compounds, alkylbenzyldimethyl, chlorides
- 9003-39-8Povidone
- 10161-34-9Trenbolone acetate
- 402957-28-2Telaprevir
- 68-19-9Cyanocobalamin
- 7631-86-9Silicon dioxide
- 302-79-4Tretinoin
- 77-92-9Citric acid
|
Basic Information |
|
Post buying leads |
|
Suppliers |
|
Cas Database |
| Name |
Menthyl isovalerate |
EINECS | 240-460-1 |
| CAS No. | 16409-46-4 | Density | 0.909 |
| PSA | 26.30000 | LogP | 4.03650 |
| Solubility | N/A | Melting Point |
1.3°C (estimate) |
| Formula | C15H28 O2 | Boiling Point | 269.5°Cat760mmHg |
| Molecular Weight | 240.386 | Flash Point | 113 ºC |
| Transport Information | N/A | Appearance | COA |
| Safety | Low toxicity by ingestion. ingestion and skin contact. A moderate skin contact irritant. When heated to decomposition it emits acrid smoke and irritating vapors. | Risk Codes | R36/37/38 |
| Molecular Structure |
|
Hazard Symbols |
|
| Synonyms |
Isovalericacid, p-menth-3-yl ester (7CI); Menthol, isovalerate (8CI); Menthyl isovalerate |
Article Data | 5 |
Menthyl isovalerate Synthetic route
| Conditions | Yield |
|---|---|
| With palladium diacetate; hydrogen; toluene-4-sulfonic acid; triphenylphosphine In xylene at 100℃; under 13680 Torr; for 2h; | 99.7% |
| With hydrogen; bis-triphenylphosphine-palladium(II) chloride In 1,4-dioxane; xylene at 130℃; under 33440 Torr; for 21h; Product distribution; var. reactions conditions; | 62% |
| With hydrogen; bis-triphenylphosphine-palladium(II) chloride In 1,4-dioxane; xylene at 130℃; under 33440 Torr; for 21h; | 62% |
| With palladium diacetate; hydrogen; toluene-4-sulfonic acid; triphenylphosphine In xylene at 100℃; under 13680 Torr; for 2h; other rate of hydrocarboxylation, var. component ratio, var. solvents; |
| Conditions | Yield |
|---|---|
| With sulfuric acid at 100 - 110℃; -isovalerate; | |
| With mineral acid at 70 - 80℃; isovaleric acid l-menthyl ester; |
| Conditions | Yield |
|---|---|
| With pyridine; benzene isovaleric acid l-menthyl ester; |
Menthyl isovalerate Chemical Properties
IUPAC Name: (5-methyl-2-propan-2-ylcyclohexyl) 3-methylbutanoate
Synonyms of Menthyl 3-menthylbutyrate (CAS NO.16409-46-4): 1-Isopropyl-4-methylcyclohex-2-yl 3-methylbutanoate ; 2-06-00-00043 (Beilstein Handbook Reference) ; 5-Methyl-2-(1-methylethyl)cyclohexyl 3-methylbutanoate ; BRN 3200250 ; Butanoic acid, 3-methyl-, 5-methyl-2-(1-methylethyl)cyclohexyl ester ; EINECS 240-460-1 ; FEMA No. 2669 ; Menth-3-yl isovalerate ; Menthyl 3-menthylbutyrate ; Menthyl 3-methylbutanoate ; Menthyl isopentanoate ; Menthyl isovalerate ; Menthyl isovalerianate ; Mentyl isovalerate ; P-Menth-3-yl isovalerate ; (1alpha,2beta,5alpha)-3-Methylbutanoic acid, 5-methyl-2-(1-methylethyl)cyclohexyl ester ; Isovaleric acid, p-menth-3-yl ester (7CI) ; Menthol, isovalerate
CAS NO: 16409-46-4
Molecular Formula of Menthyl 3-menthylbutyrate (CAS NO.16409-46-4): C15H28O2
Molecular Weight: 240.3816
H bond acceptors: 2
H bond donors: 0
Freely Rotating Bonds: 5
Polar Surface Area: 26.3 Å2
Index of Refraction: 1.452
Molar Refractivity: 71.19 cm3
Molar Volume: 263.5 cm3
Surface Tension: 29.9 dyne/cm
Density: 0.91 g/cm3
Flash Point: 124.1 °C
Enthalpy of Vaporization: 50.76 kJ/mol
Boiling Point: 269.5 °C at 760 mmHg
Vapour Pressure: 0.00724 mmHg at 25°C
Molecular Structure: .png)
Menthyl isovalerate Toxicity Data With Reference
| Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
|---|---|---|---|---|---|
| rabbit | LD50 | skin | > 5gm/kg (5000mg/kg) | Food and Chemical Toxicology. Vol. 20, Pg. 735, 1982. | |
| rat | LD50 | oral | > 5gm/kg (5000mg/kg) | Food and Chemical Toxicology. Vol. 20, Pg. 735, 1982. |
Menthyl isovalerate Consensus Reports
Reported in EPA TSCA Inventory.
Menthyl isovalerate Safety Profile
Hazard Codes of Menthyl 3-menthylbutyrate (CAS NO.16409-46-4): Xi
Risk Statements: 36/37/38
R36/37/38: Irritating to eyes, respiratory system and skin.
Safety Statements: 26-36
S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. S36: Wear suitable protective clothing.
WGK Germany: 2
RTECS: OT0720000
Low toxicity by ingestion. ingestion and skin contact. A moderate skin contact irritant. When heated to decomposition it emits acrid smoke and irritating vapors.
What can I do for you?
Get Best Price
