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Home > Encyclopedia > 12-MERCAPTODODECANOICACID

12-MERCAPTODODECANOICACID

12-MERCAPTODODECANOICACID structure

12-MERCAPTODODECANOICACID 

structure
  • CAS No:

    82001-53-4

  • Formula:

    C12H24O2S

  • Chemical Name:

    12-MERCAPTODODECANOICACID

  • Synonyms:

    12-Mercaptododecanoic acid;12-Sulfanyldodecanoic acid;Dodecanoic acid, 12-mercapto-;ACMC-20aoz7;12-Sulfanyldodecanoic acid #;Dodecanoic acid,12-mercapto-;SCHEMBL412496;12-mercapto-1-dodecanoic acid;CTK5E9300;DTXSID70340708

  • Categories:

    Organic Chemistry  >  Heterocyclic Ring

12-MERCAPTODODECANOICACID Basic Attributes

232.382

232.15000

DTXSID70340708

2930909090

Characteristics

76.10000

3.90180

0.987g/cm3

46-50 °C

366.5ºC at 760 mmHg

>110℃

1.482

2-8°C

Safety Information

UN 3335

3

36/37/38

26

Xi

P261-P305 + P351 + P338

H315-H319-H335

|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 38 companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

12-MERCAPTODODECANOICACID Use and Manufacturing

The compound is used to prepare hydrophilic self-assembled monolayer. The resulting monolayer with carboxylic acid as the end group can be further functionalized to introduce more end groups of the complex. Used to study the effect of molecular structure on the stacking accuracy of copper-bonded α,ω-mercaptoalkanoic acid ~~"molecular rulers~~".

Computed Properties

Molecular Weight:232.38
XLogP3:4.6
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:11
Exact Mass:232.14970118
Monoisotopic Mass:232.14970118
Topological Polar Surface Area:38.3
Heavy Atom Count:15
Complexity:149
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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