4-tert-Butylcyclohexyl acetate supplier

Name
4-tert-Butylcyclohexyl acetate
EINECS 250-954-9
CAS No. 32210-23-4
Article Data11
CAS DataBase
Density 0.93 g/cm³
Solubility 39.6mg/L at 20℃
Melting Point 228 - 230oC
Formula C₁₂H₂₂O₂
Boiling Point 222.2 °C at 760 mmHg
Molecular Weight 198.305
Flash Point 90.8 °C
Transport Information
Appearance Clear, colourless liquid
Safety 26-37/39
Risk Codes 36/37/38
Molecular Structure
Hazard Symbols Xi
Synonyms Cyclohexanol,4-(1,1-dimethylethyl)-, acetate (9CI);Cyclohexanol, 4-tert-butyl-, acetate(6CI,7CI,8CI);4-(1,1-Dimethylethyl)cyclohexyl acetate;4-tert-Butylcyclohexanol acetate;Boisinol A464D;Dorisyl;Madeflor;Oryclon extra;Oryclone;Oryclone special;Verbeniax;Vertinate;Vertopol;Ylanate;p-t-BCHA;p-tert-Butylcyclohexyl acetate;para-tert-Butylcyclohexyl acetate;PTBCHA;
PSA 26.30000
LogP 3.15440

4-tert-Butylcyclohexyl acetate Chemical Properties

Molecular Formula: C₁₂H₂₂O₂
Molar mass: 198.3019 g/mol
EINECS: 250-954-9
Density: 0.93 g/cm³
Flash Point: 90.8 °C
Index of Refraction: 1.45
Boiling Point: 222.2 °C at 760 mmHg
Vapour Pressure: 0.103 mmHg at 25°C
Stable: Stable. Flammable. Incompatible with strong oxidizing agents
Product categories of 4-tert-Butylcyclohexyl acetate (32210-23-4): Pharmaceutical Raw Materials;Esters;Carbonyl Compounds;Alphabetical Listings;Flavors and Fragrances
Structure of 4-tert-Butylcyclohexyl acetate (32210-23-4):

XLogP3-AA: 3.4
H-Bond Donor: 0
H-Bond Acceptor: 2
Systematic Name: (4-Tert-butylcyclohexyl) acetate
SMILES: O=C(OC1CCC(CC1)C(C)(C)C)C
InChI: InChI=1/C12H22O2/c1-9(13)14-11-7-5-10(6-8-11)12(2,3)4/h10-11H,5-8H2,1-4H3
InChIKey: MBZRJSQZCBXRGK-UHFFFAOYAF
Std. InChI: InChI=1S/C12H22O2/c1-9(13)14-11-7-5-10(6-8-11)12(2,3)4/h10-11H,5-8H2,1-4H3
Std. InChIKey: MBZRJSQZCBXRGK-UHFFFAOYSA-N

4-tert-Butylcyclohexyl acetate Uses

4-tert-Butylcyclohexyl acetate (32210-23-4) is mainly used for daily chemical flavor.

4-tert-Butylcyclohexyl acetate Toxicity Data With Reference

1.		skn-rbt 500 mg/24H MOD		FCTXAV Food and Cosmetics Toxicology. 16 (1978),637.
2.		orl-rat LD50:5000 mg/kg		FCTXAV Food and Cosmetics Toxicology. 16 (1978),637.

4-tert-Butylcyclohexyl acetate Consensus Reports

Reported in EPA TSCA Inventory.

4-tert-Butylcyclohexyl acetate Safety Profile

Mildly toxic by ingestion. A skin irritant. When heated to decomposition it emits acrid smoke and irritating fumes. See also ESTERS.

Hazard Codes: Xi
Risk Statements:
36: Irritating to the eyes
37: Irritating to the respiratory system
38: Irritating to the skin
Safety Statements:
26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice
36: Wear suitable protective clothing
37: Wear suitable gloves
39: Wear eye/face protection

4-tert-Butylcyclohexyl acetate Specification

4-tert-Butylcyclohexyl acetate (32210-23-4) also can be called Vertenex ; Cyclohexanol, 4-(1,1-dimethylethyl)-, acetate ; Cyclohexanol, 4-tert-butyl-, acetate (8CI) and 4-(2-Methyl-2-propanyl)cyclohexyl acetate .

Product Name

4-tert-Butylcyclohexyl acetate