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Hydrocinnamyl propionate

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Name

Hydrocinnamyl propionate

EINECS 204-571-9
CAS No. 122-74-7 Density 1.0 g/mL at 25 °C(lit.)
PSA 26.30000 LogP 2.57240
Solubility N/A Melting Point N/A
Formula C12H16 O2 Boiling Point 280.3 °C at 760 mmHg
Molecular Weight 192.258 Flash Point 116.9 °C
Transport Information N/A Appearance COLORLESS TO LIGHT YELLOW LIQUID
Safety Low toxicity by ingestion and skin contact. A skin irritant. When heated to decomposition it emits acrid smoke and irritating fumes. Risk Codes 36/37/38
Molecular Structure Molecular Structure of 122-74-7 (3-PHENYL PROPYL PROPIONATE) Hazard Symbols IrritantXi
Synonyms

1-Propanol,3-phenyl-, propionate (8CI); Benzenepropanol, propanoate (9CI); 3-Phenylpropylpropionate; NSC 6032

Article Data 5

Hydrocinnamyl propionate Chemical Properties

IUPAC: 3-Phenylpropyl propanoate
 Hydrocinnamyl propionate (CAS NO.122-74-7) is also called for 1-Propanol, 3-phenyl-, propionate ; 3-Phenyl-1-propanol propionate ; 3-Phenylpropyl propionate ; 4-06-00-03201 (Beilstein Handbook Reference) ; AI3-18535 ; BRN 3272005 ; Benzenepropanol, propanoate ; EINECS 204-571-9 ; FEMA No. 2897 ; NSC 6032 ; Phenylpropyl propionate and so on.
CAS: 122-74-7
Molecular Formula: C12H16O2
Molecular Weight: 192.25
EINECS: 204-571-9
ACD/LogP: 3.40
ACD/LogD (pH 5.5): 3.4 
ACD/LogD (pH 7.4): 3.4 
ACD/BCF (pH 5.5): 227.36 
ACD/BCF (pH 7.4): 227.36 
ACD/KOC (pH 5.5): 1692.57 
ACD/KOC (pH 7.4): 1692.57 
H bond acceptors: 2 
H bond donors: 0 
Freely Rotating Bonds: 6 
Heavy Atom Count: 14
Formal Charge: 0
Complexity: 160
Isotope Atom Count: 0
Defined Atom StereoCenter Count: 0
Undefined Atom StereoCenter Count: 0
Defined Bond StereoCenter Count: 0
Undefined Bond StereoCenter Count: 0
Covalently-Bonded Unit Count: 1
Index of Refraction: 1.496 
Molar Refractivity: 56.1 cm3 
Molar Volume: 191.7 cm3 
Surface Tension: 35.3 dyne/cm 
Density: 1.002 g/cm3 
Flash Point: 116.9°C 
Enthalpy of Vaporization: 51.91 kJ/mol 
Boiling Point: 280.3°C at 760 mmHg 
Vapour Pressure: 0.00381 mmHg at 25°C 
The molecular structure of  Hydrocinnamyl propionate with CAS NO.of 122-74-7:

Hydrocinnamyl propionate Toxicity Data With Reference

1.    

skn-rbt 500 mg/24H MOD

    FCTOD7    Food and Chemical Toxicology. 20 (1982),809.
2.    

orl-rat LD50:>5 g/kg

    FCTOD7    Food and Chemical Toxicology. 20 (1982),809.
3.    

skn-rbt LD50:>5 g/kg

    FCTOD7    Food and Chemical Toxicology. 20 (1982),809.

Hydrocinnamyl propionate Consensus Reports

Reported in EPA TSCA Inventory.

Hydrocinnamyl propionate Safety Profile

Low toxicity by ingestion and skin contact. A skin irritant. When heated to decomposition it emits acrid smoke and irritating fumes.
Hazard Codes:  Xi Irritant
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.
RTECS:  UB9338400

Hydrocinnamyl propionate Specification

Removal in wastewater treatment of  Hydrocinnamyl propionate (CAS NO.122-74-7):
Total removal:14.52  percent
Total biodegradation:0.19  percent
Total sludge adsorption:14.00  percent
Total to air:0.32  percent
(using 10000 hr Bio P,A,S)

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