(Z)-3-hexen-1-yl valerate supplier

Name
N-VALERIC ACID CIS-3-HEXEN-1-YL ESTER
EINECS 252-761-5
CAS No. 35852-46-1
Density 0.889 g/cm³
Solubility
Melting Point -58.7°C (estimate)
Formula C₁₁H₂₀O₂
Boiling Point 237.1 °C at 760 mmHg
Molecular Weight 184.15
Flash Point 83.3 °C
Transport Information
Appearance Colorless to light yellow liquid. Colourless liquid; fruity, ripe apple or pear-like aroma
Safety 61
Risk Codes 51/53
Molecular Structure
Hazard Symbols N
Synonyms Pentanoicacid, (3Z)-3-hexenyl ester (9CI);Z-3-Hexenyl valerate;cis-3-Hexenyl pentanoate;cis-Hex-3-en-1-yl pentanoate;
PSA 26.30000
LogP 3.07610

(Z)-3-hexen-1-yl valerate Chemical Properties

Molecular Formula: C₁₁H₂₀O₂
Molar mass: 184.28 g/mol
EINECS: 252-761-5
Density: 0.889 g/cm³
Flash Point: 83.3 °C
Index of Refraction: 1.442
Boiling Point: 237.1 °C at 760 mmHg
Vapour Pressure: 0.0458 mmHg at 25°C
Structure of cis-3-Hexenyl valerate (35852-46-1):

XLogP3-AA: 3.3
H-Bond Donor: 0
H-Bond Acceptor: 2
IUPAC Name of cis-3-Hexenyl valerate (35852-46-1): [(E)-hex-3-enyl] pentanoate
Canonical SMILES: CCCCC(=O)OCCC=CCC
Isomeric SMILES: CCCCC(=O)OCC/C=C/CC
InChI: InChI=1S/C11H20O2/c1-3-5-7-8-10-13-11(12)9-6-4-2/h5,7H,3-4,6,8-10H2,
1-2H3/b7-5+
InChIKey: XPFTVTFOOTVHIA-FNORWQNLSA-N

(Z)-3-hexen-1-yl valerate Toxicity Data With Reference

1.		orl-rat LDLo:5 g/kg		FCTOD7 Food and Chemical Toxicology. 30 (1992),47S.
2.		skn-rbt LDLo:5 g/kg		FCTOD7 Food and Chemical Toxicology. 30 (1992),47S.

(Z)-3-hexen-1-yl valerate Consensus Reports

Reported in EPA TSCA Inventory.

(Z)-3-hexen-1-yl valerate Safety Profile

Low toxicity by ingestion and skin contact. When heated to decomposition it emits acrid smoke and irritating vapors.

(Z)-3-hexen-1-yl valerate Specification

cis-3-Hexenyl valerate (35852-46-1) also can be called (Z)-3-Hexen-1-ol, pentanoate ; (E)-Hex-3-enyl valerate ; Neopentyl ethylphosphonofluoridoate ; cis-3-Hexenyl pentanoate ; (E)-3-Hexen-1-ol, pentanoate ; (Z)-Hex-3-enyl valerate ; (Z)-3-Hexenyl valerate .

Product Name

N-VALERIC ACID CIS-3-HEXEN-1-YL ESTER

(Z)-3-hexen-1-yl valerate Chemical Properties

(Z)-3-hexen-1-yl valerate Toxicity Data With Reference

(Z)-3-hexen-1-yl valerate Consensus Reports

(Z)-3-hexen-1-yl valerate Safety Profile

(Z)-3-hexen-1-yl valerate Specification

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