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1-Iodohexadecane

1-Iodohexadecane structure

1-Iodohexadecane 

structure
  • CAS No:

    544-77-4

  • Formula:

    C16H33I

  • Chemical Name:

    1-Iodohexadecane

  • Synonyms:

    Hexadecane,1-iodo-;1-Iodohexadecane;Cetyl iodide;Hexadecyl iodide

  • Categories:

    Surfactant  >  Industrial Surfactant

Description

colourless liquid, may discolour in light

1-Iodohexadecane Basic Attributes

352.34

352.34

208-879-4

JO95X48M8O

DTXSID0049317

29033990

Characteristics

0

6.90270

1.12639 g/cm3 @ Temp: 20 °C

22 °C

212 °C

>230 °F

n20/D 1.4806(lit.)

Insoluble in water.

Store below +30°C.

1.65e-05 mmHg

Safety Information

UN 3082 9 / PGIII

3

36/37/38

26-37/39

Xi

Stable, but light sensitive. Incompatible with strong bases, strong oxidizing agents.

P261-P273-P305 + P351 + P338

H315-H319-H335-H400

|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P273, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P391, P403+P233, P405, and P501|Aggregated GHS information provided by 39 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Drug Information

1-iodohexadecane

1-Iodohexadecane Use and Manufacturing

Methods of Manufacturing

It is derived from the reaction of n-hexadecyl alcohol and phosphorus triiodide. Heat n-hexadecanol, red phosphorus and iodine together to melt the cetyl alcohol, continue heating to about 150°C, and stir for 5 hours. Cool to room temperature and extract with ether. After the extract is washed and dried, the ether is distilled off, and the remainder is subjected to vacuum distillation to collect 220-225°C (2.93kPa) fractions to obtain the finished product. The yield is about 80%.

Uses

Used in the synthesis of detergents and organic synthesis

Hexadecane, 1-iodo-: ACTIVE

Computed Properties

Molecular Weight:352.34
XLogP3:9.6
Rotatable Bond Count:14
Exact Mass:352.16270
Monoisotopic Mass:352.16270
Heavy Atom Count:17
Complexity:123
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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