1-Undecanol

1-Undecanol
Compound Structure:
Synonyms: 1-UNDECANOL;Undecan-1-ol;Undecyl alcohol;112-42-5;Undecanol;n-Undecanol;n-Undecyl alcohol;1-Hendecanol;Hendecanoic alcohol;Hendecyl alcohol;Alcohol C-11;n-Hendecylenic alcohol
Compound ID: NMPC-133
PubChem ID:

8184

Molecular Formula: C11H24O
Canonical SMILES: CCCCCCCCCCCO
InChIKey: KJIOQYGWTQBHNH-UHFFFAOYSA-N
About the compound:

Ethynyltrimethylsilane, also referred to as 1-Pentyn-1-yltrimethylsilane, is a chemical compound that appears as a colorless to slightly pale-yellow liquid. To maintain its stability and prevent reactions with moisture or air, it should be stored in a cool, dark, and well-ventilated place, preferably at ambient temperatures. It's essential to store it under an inert gas to protect it from moisture and air, as it is known to be sensitive to both.

GHS Hazard Statements

H226 (100%): Flammable liquid and vapor [Warning Flammable liquids]

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]

H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]

H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]


Properties:

Chemical and Physical Properties

Property Name

Property Value

Molecular Weight

172.31 g/mol

XLogP3

4.6

Hydrogen Bond Donor Count

1

Hydrogen Bond Acceptor Count

1

Rotatable Bond Count

9

Exact Mass

172.182715385 g/mol

Monoisotopic Mass

172.182715385 g/mol

Topological Polar Surface Area

20.2Ų

Heavy Atom Count

12

Formal Charge

0

Complexity

71.4

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

1-undecanol appears as a water -white liquid with a mild odor. Flash point 250 °F. Slightly soluble in water. Considered a marine pollutant by DOT. Immediate steps should be taken to limit its spread to the environment. As a liquid it can easily penetrate the soil and contaminate groundwater or streams. Mildly irritating to both the eyes and skin.

Boiling Point

473 °F at 760 mmHg (USCG, 1999)

Melting Point

60.6 °F (USCG, 1999)

Density

0.835 at 68 °F (USCG, 1999)

Solubility 

Soluble in ethanol; very soluble in ether

Vapor Pressure

0.00297 [mmHg]

Source: PubChem

Source Species: Pteris togoensis
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