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VALERIC ACID, 2-PROPYL-, THYMYL ESTER

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Name

VALERIC ACID, 2-PROPYL-, THYMYL ESTER

EINECS N/A
CAS No. 30129-29-4 Density 0.943g/cm3
PSA 26.30000 LogP 5.24020
Solubility N/A Melting Point N/A
Formula C18H28 O2 Boiling Point 344.7°Cat760mmHg
Molecular Weight 276.46 Flash Point 118.8°C
Transport Information N/A Appearance N/A
Safety Moderately toxic by ingestion and intraperitoneal routes. When heated to decomposition it emits acrid smoke and irritating vapors. Risk Codes N/A
Molecular Structure Molecular Structure of 30129-29-4 (5-methyl-2-(propan-2-yl)phenyl 2-propylpentanoate) Hazard Symbols N/A
Synonyms

Valericacid, 2-propyl-, thymyl ester (8CI)

 

VALERIC ACID, 2-PROPYL-, THYMYL ESTER Chemical Properties

IUPAC Name: (5-methyl-2-propan-2-ylphenyl) 2-propylpentanoate
Synonyms: 2-Propylvaleric acid thymyl ester ; Pentanoic acid, 2-propyl-, thymyl ester ; Thymyl 2-propylvalerate
Molecular Formula of Valeric acid, 2-propyl-, thymyl ester (CAS NO.30129-29-4 ) : C18H28O2
Structure Descriptors:
   Smiles:C(C(CCC)CCC)(=O)Oc1cc(C)ccc1C(C)C 
Structure of  Valeric acid, 2-propyl-, thymyl ester (CAS NO.30129-29-4 ) :

Molecular Weight: 276.46 g/mol
Index of Refraction: 1.487
Density: 0.943 g/cm3
Flash Point: 118.8 °C
Surface Tension: 32.2 dyne/cm
Enthalpy of Vaporization: 58.87 kJ/mol
Boiling Point: 344.7 °C at 760 mmHg
Vapour Pressure: 6.48E-05 mmHg at 25°C

 

VALERIC ACID, 2-PROPYL-, THYMYL ESTER Toxicity Data With Reference

1.    

orl-rat LD50:>2 g/kg

    CHTPBA    Chimica Therapeutica. 3 (1968),433.
2.    

ipr-rat LD50:>2 g/kg

    CHTPBA    Chimica Therapeutica. 3 (1968),433.
3.    

orl-mus LD50:>2500 mg/kg

    CHTPBA    Chimica Therapeutica. 3 (1968),433.
4.    

ipr-mus LD50:>2 g/kg

    CHTPBA    Chimica Therapeutica. 3 (1968),433.

VALERIC ACID, 2-PROPYL-, THYMYL ESTER Safety Profile

Moderately toxic by ingestion and intraperitoneal routes. When heated to decomposition Valeric acid, 2-propyl-, thymyl ester (CAS NO.30129-29-4 ) emits acrid smoke and irritating vapors.

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