Alpha.-Tridecene

Compound Structure:

Synonyms:

1-TRIDECENE;2437-56-1;tridec-1-ene;N-Tridec-1-ene;Tridecylene;Undecylethylene;alpha-Tridecene;1-Tridecene, 97%;Tridecene-1;.alpha.-Tridecene;MFCD00008976

Compound ID:

NMPC-573

PubChem ID:

17095

Molecular Formula:

C13H26

Canonical SMILES:

CCCCCCCCCCCC=C

InChIKey:

VQOXUMQBYILCKR-UHFFFAOYSA-N

About the compound:

GHS Hazard Statements

• H304 (11.36%): May be fatal if swallowed and enters airways [Danger Aspiration hazard]

• H319 (88.64%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]

Properties:

Chemical and Physical Properties

Property Name	Property Value
Molecular Weight	182.35 g/mol
XLogP3	7.3
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	0
Rotatable Bond Count	10
Exact Mass	182.203450829 g/mol
Monoisotopic Mass	182.203450829 g/mol
Topological Polar Surface Area	0Å²
Heavy Atom Count	13
Formal Charge	0
Complexity	94.2
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
Compound Is Canonicalized	Yes
Physical Description	Watery colorless liquid with a mild pleasant odor. Less dense than water and insoluble in water. Hence floats on water. (USCG, 1999)
Boiling Point	451 °F at 760 mmHg (USCG, 1999)
Melting Point	-11 °F (USCG, 1999)
Density	0.765 at 68 °F (USCG, 1999)
Solubility	Insol in water; sol in benzene; very sol in ethanol and in ether
Vapor Pressure	0.06 [mmHg]

Source: PubChem

Source Species:

Scleria depressa

Download SDF