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trans-2-Octen-1-ol

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Name

trans-2-Octen-1-ol

EINECS 242-288-2
CAS No. 18409-17-1 Density 0.85
PSA 20.23000 LogP 2.11520
Solubility Soluble in hexane, triacetin; Insoluble in water Melting Point -31.5°C (estimate)
Formula C8H16 O Boiling Point 195.8 °C at 760 mmHg ,85-87 °C10 mm Hg(lit.)
Molecular Weight 128.214 Flash Point 85 ºC
Transport Information N/A Appearance Clear colourless liquid
Safety 24 25 26 36 Risk Codes R36/38   
Molecular Structure Molecular Structure of 18409-17-1 (trans-2-Octen-1-ol) Hazard Symbols
Synonyms

2-Octen-1-ol,(E)- (8CI); (2E)-Oct-2-en-1-ol; (E)-2-Octen-1-ol; (E)-2-Octenol;n-Oct-trans-2-en-1-ol; trans-2-Octen-1-ol; trans-2-Octenol

Article Data 73

trans-2-Octen-1-ol Chemical Properties

Molecule structure of trans-2-Octen-1-ol (CAS NO.18409-17-1):

IUPAC Name: (E)-Oct-2-en-1-ol 
Molecular Weight: 128.21204 [g/mol]
Molecular Formula: C8H16
Index of Refraction: 1.449
Molar Refractivity: 40.7 cm3
Molar Volume: 151.7 cm3
Polarizability: 16.13×10-24 cm3
Surface Tension: 29.7 dyne/cm
Density: 0.845 g/cm3
Flash Point: 78.1 °C
Enthalpy of Vaporization: 50.26 kJ/mol
Boiling Point: 195.8 °C at 760 mmHg
Vapour Pressure: 0.107 mmHg at 25 °C
Water Solubility: insoluble
XLogP3-AA: 2.5
H-Bond Donor: 1
H-Bond Acceptor: 1
Rotatable Bond Count: 5
Exact Mass: 128.120115
MonoIsotopic Mass: 128.120115
Topological Polar Surface Area: 20.2
Heavy Atom Count: 9
Complexity: 67
Defined Bond StereoCenter Count 1
Covalently-Bonded Unit Count 1
Canonical SMILES: CCCCCC=CCO
Isomeric SMILES: CCCCC/C=C/CO
InChI: InChI=1S/C8H16O/c1-2-3-4-5-6-7-8-9/h6-7,9H,2-5,8H2,1H3/b7-6+
InChIKey: AYQPVPFZWIQERS-VOTSOKGWSA-N
EINECS: 242-288-2
Product Categories of trans-2-Octen-1-ol (CAS NO.18409-17-1): Acyclic; Alkenes; Organic Building Blocks; Alphabetical Listings; Flavors and Fragrances; O-P

trans-2-Octen-1-ol Safety Profile

Hazard Codes: IrritantXi
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: 26-36-36/37-37/39 
S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. 
S36:Wear suitable protective clothing. 
S36/37:Wear suitable protective clothing and gloves. 
S37/39:Wear suitable gloves and eye/face protection.
WGK Germany: 3

trans-2-Octen-1-ol Specification

 trans-2-Octen-1-ol (CAS NO.18409-17-1) is also named as (E)-2-Octen-1-ol ; 2-Octen-1-ol ; (E)-Oct-2-en-1-ol ; 2-Octen-1-ol, (2E)- ; 2-Octen-1-ol, (E)-; 2-Octen-1-ol, (2E)- . trans-2-Octen-1-ol (CAS NO.18409-17-1) is clear colorless liquid.

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