1-Tetradecene

1-Tetradecene
Compound Structure:
Synonyms: 1-TETRADECENE;1120-36-1;Tetradec-1-ene;Tetradecene;n-Tetradec-1-ene;1-Tetradecylene;alpha-Tetradecene;1-butadecene;Neodene 14
Compound ID: NMPC-130
PubChem ID:

14260
Molecular Formula: C14H28
Canonical SMILES: CCCCCCCCCCCCC=C
InChIKey: HFDVRLIODXPAHB-UHFFFAOYSA-N
About the compound:

1-tetradecene is an unbranched alkene with a chain of fourteen carbon atoms and a double bond between C-1 and C-2. It exists as a watery, colorless liquid with a mild and pleasant odor. This compound also has the unique property of floating on water.1-Tetradecene is naturally occurring and can be found in various organisms, including Pseudoceratina purpurea, Aspergillus ustus, and others.

GHS Hazard Statements

• H304 (99.49%): May be fatal if swallowed and enters airways [Danger Aspiration hazard]

• H315 (15.65%): Causes skin irritation [Warning Skin corrosion/irritation]
Properties:

Chemical and Physical Properties

Property Name

Property Value

Molecular Weight

196.37 g/mol

XLogP3

7.9

Hydrogen Bond Donor Count

0

Hydrogen Bond Acceptor Count

0

Rotatable Bond Count

11

Exact Mass

196.219100893 g/mol

Monoisotopic Mass

196.219100893 g/mol

Topological Polar Surface Area

0Ų

Heavy Atom Count

14

Formal Charge

0

Complexity

105

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 liquid; colorless; mild pleasant odor. Floats on water. (USCG, 1999)

Boiling Point

484 °F at 760 mmHg (USCG, 1999)

Melting Point

8.8 °F (USCG, 1999)

Density

0.771 at 68 °F (USCG, 1999)

Solubility 

SOL IN ETHANOL, ETHER, BENZENE

Vapor Pressure

4.55 mmHg at 220 °F (USCG, 1999)

                                                                   

U.S. Coast Guard. 1999. Chemical Hazard Response Information System (CHRIS) - Hazardous Chemical Data. Commandant Instruction 16465.12C. Washington, D.C.: U.S. Government Printing Office.

Source: PubChem
Source Species: Phyllanthus muellerianus
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