- Hexyl 2,2,2-trichloroacetate
- Hexyl 2,2-dimethylpropanoate
- Hexyl 2-methylbutyrate
- Hexyl 3-methylbutanoate
- Hexyl acetate
- Hexyl acrylate
- Hexyl alcohol
- Hexyl benzoate
- Hexyl beta-D-glucopyranoside
- Hexyl butyrate
- 5431-35-6Phosphonic acid,P-(4-chlorophenyl)-
- 5431-39-04-Quinolinamine,7-chloro-N-(4-chlorophenyl)-
- 5431-44-72,6-Pyridinedicarboxaldehyde
- 54314-84-0Benzene,[(3-bromopropoxy)methyl]-
- 54314-85-1Phosphonium,triphenyl[3-(phenylmethoxy)propyl]-, bromide (1:1)
- 5431-64-18-Quinolinamine,N-[3-[3-(diethylamino)propoxy]propyl]-6-methoxy-
- 543-18-0Ethanesulfonic acid,2-[(aminoiminomethyl)amino]-
- 54-31-9Furosemide
- 543-20-4Butanedioyl dichloride
- 5432-04-24-[[(E)-3-carboxyprop-2-enoyl]amino]benzoic acid
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 |
Hexyl mandelate |
EINECS | N/A |
| CAS No. | 5431-31-2 | Density | 1.059g/cm3 |
| PSA | N/A | LogP | N/A |
| Solubility | N/A | Melting Point |
N/A |
| Formula | C14H20O3 | Boiling Point | 344.6°C at 760 mmHg |
| Molecular Weight | 236.311 | Flash Point | 138.2°C |
| Transport Information | N/A | Appearance | N/A |
| Safety | Mildly toxic by ingestion and skin contact. A skin irritant. When heated to decomposition it emits acrid smoke and fumes. See also ESTERS. | Risk Codes | N/A |
| Molecular Structure |
|
Hazard Symbols | N/A |
| Synonyms |
N/A |
Article Data | 5 |
Hexyl mandelate Chemical Properties
Molecular Structure of Hexyl mandelate (CAS NO. 5431-31-2):
IUPAC Name: Hexyl 2-hydroxy-2-phenylacetate
Molecular Formula: C14H20O3
Molecular Weight: 236.306800 g/mol
XLogP3: 3.5
H-Bond Donor: 1
H-Bond Acceptor: 3
Canonical SMILES: CCCCCCOC(=O)C(C1=CC=CC=C1)O
InChI: InChI=1S/C14H20O3/c1-2-3-4-8-11-17-14(16)13(15)12-9-6-5-7-10-12/h5-7,9-10,13,15H,2-4,8,11H2,1H3
InChIKey: WTWKQARYVVXCNG-UHFFFAOYSA-N
Index of Refraction: 1.511
Molar Refractivity: 66.91 cm3
Molar Volume: 223 cm3
Surface Tension: 40.5 dyne/cm
Density: 1.059 g/cm3
Flash Point: 138.2 °C
Enthalpy of Vaporization: 62.12 kJ/mol
Boiling Point: 344.6 °C at 760 mmHg
Vapour Pressure: 2.48E-05 mmHg at 25 °C
Water Solubility: 250.5 mg/L at 25 °C
BRN of Hexyl mandelate (CAS NO. 5431-31-2): 3135230
Hexyl mandelate Toxicity Data With Reference
| 1. | skn-rbt 10 mg/24H open MLD | AIHAAP American Industrial Hygiene Association Journal. 23 (1962),95. | ||
| 2. | orl-rat LD50:17 g/kg | AIHAAP American Industrial Hygiene Association Journal. 23 (1962),95. | ||
| 3. | skn-rbt LD50:15 g/kg | AIHAAP American Industrial Hygiene Association Journal. 23 (1962),95. |
Hexyl mandelate Safety Profile
Mildly toxic by ingestion and skin contact. A skin irritant. When heated to decomposition it emits acrid smoke and fumes. See also ESTERS.
Hexyl mandelate Specification
Hexyl mandelate with cas registry number of 5431-31-2 is also called for 4-10-00-00571 (Beilstein Handbook Reference) ; AI 3-4202 ; AI3-04202 ; Benzeneacetic acid, alpha-hydroxy-, hexyl ester (9CI) ; Hexylester kyseliny mandlove ; Hexylester kyseliny mandlove [Czech] ; Mandelic acid, hexyl ester .
What can I do for you?
Get Best Price
