IUPAC Name: 4-Prop-1-en-2-ylcyclohexene-1-carbaldehyde
Molecular Weight: 150.21756 g/mol
Molecular Formula: C10H14O
Surface Tension: 40.1 dyne/cm
Density: 1.002 g/cm3
Flash Point: 95.6 °C
Enthalpy of Vaporization: 47.48 kJ/mol
Boiling Point: 238 °C at 760 mmHg
Vapour Pressure: 0.0434 mmHg at 25 °C
Refractive Index: n20/D 1.509
XLogP3-AA: 2.6
H-Bond Acceptor: 1
Rotatable Bond Count: 2
Exact Mass: 150.104465
MonoIsotopic Mass: 150.104465
Topological Polar Surface Area: 17.1
Heavy Atom Count: 11
Canonical SMILES: CC(=C)C1CCC(=CC1)C=O
Isomeric SMILES: CC(=C)[C@H]1CCC(=CC1)C=O
InChI: InChI=1S/C10H14O/c1-8(2)10-5-3-9(7-11)4-6-10/h3,7,10H,1,4-6H2,2H3/t10-/m1/s1
InChIKey: RUMOYJJNUMEFDD-SNVBAGLBSA-N
EINECS: 218-302-8
Product Categories: Aromatic Aldehydes & Derivatives (substituted);Biochemistry;Monocyclic Monoterpenes;Terpenes
the molecular structure of L(-)-Perillaldehyde (CAS NO.18031-40-8):
Hazard Codes:Xi
Risk Statements: 36/37/38
R36/37/38:Irritating to eyes, respiratory system and skin.
Safety Statements: 26
S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
WGK Germany: 3
RTECS: GW2967200
F: 10
L(-)-Perillaldehyde (CAS NO.18031-40-8) is also named as (-)-Perillaldehyde ; (S)-4-Isopropenyl-1-cyclohexene-1-carboxaldehyde ; CCRIS 7325 ; L(-)-Perillaldehyde ; 1-Cyclohexene-1-carboxaldehyde, 4-(1-methylethenyl)-, (4S)- ; 1-Cyclohexene-1-carboxaldehyde, 4-(1-methylethenyl)-, (S)-(-)- (9CI) ; 1-Cyclohexene-1-carboxaldehyde, 4-isopropenyl-, (S)-(-)- . L(-)-Perillaldehyde (CAS NO.18031-40-8) is clear light yellow liquid.
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