Molecular Structure of trans,trans-2,4-Decadienal (CAS NO.25152-84-5):
IUPAC Name: (2E,4E)-Deca-2,4-dienal
Molecular Formula: C10H16O
Molecular Weight: 152.23
XLogP3-AA: 3.2
H-Bond Donor: 0
H-Bond Acceptor: 1
EINECS: 246-668-9
FEMA: 3135
storage temp.: Refrigerator (+4 °C)
Index of Refraction: 1.458 Molar Refractivity: 48.67 cm3
Molar Volume: 178.1 cm3
Surface Tension: 28.9 dyne/cm
Density: 0.854 g/cm3
Flash Point: 102.3 °C
Enthalpy of Vaporization: 48.17 kJ/mol
Boiling Point: 244.6 °C at 760 mmHg
Vapour Pressure: 0.03 mmHg at 25 °C
Water Solubility: insoluble
Classification Code: Tumor data
Appearance: clear yellow liquid
Canonical SMILES: CCCCCC=CC=CC=O
Isomeric SMILES: CCCCC/C=C/C=C/C=O
InChI: InChI=1S/C10H16O/c1-2-3-4-5-6-7-8-9-10-11/h6-10H,2-5H2,1H3/b7-6+,9-8+
InChIKey: JZQKTMZYLHNFPL-BLHCBFLLSA-N
Safety Information of trans,trans-2,4-Decadienal (CAS NO.25152-84-5):
Hazard Codes: Xi
Risk Statements: 36/37/38-36/38
R36/37/38:Irritating to eyes, respiratory system and skin.
R36/38:Irritating to eyes and skin.
Safety Statements: 26-36-37/39
S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
S36:Wear suitable protective clothing.
S37/39:Wear suitable gloves and eye/face protection.
WGK Germany: 2
RTECS: HD3000000
F: 10-23
PackingGroup: III
When heated to decomposition it emits acrid smoke and irritating fumes.
trans,trans-2,4-Decadienal (CAS NO.25152-84-5), its Synonyms are (2E,4E)-2,4-Decadienal ; (2E,4E)-Decadienal ; (E,E)-2,4-Decadienal ; 2,4-Decadienal, (E,E)- ; trans,trans-2,4-Decadien-1-al ; 2-trans-4-trans-Decadienal .
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