CAS 112-53-8 Dodecanol - Materials / Alfa Chemistry

NAVIGATION

Dodecanol

PRICE INQUIRY

Catalog Number

ACM112538

CAS Number

112-53-8

Product Name

Dodecanol

Structure

Category

Solubility Enhancing Reagents

Synonyms

1-Hydroxydodecane

Description

Dodecanol is a colorless thick liquid with a sweet odor. Floats on water. Freezing point is 75°F. (USCG, 1999);Liquid; OtherSolid, Liquid; WetSolid;Liquid;Liquid;Solid;COLOURLESS LIQUID OR WHITE CRYSTALS WITH CHARACTERISTIC ODOUR.;Colourless liquid above 21?°, fatty odour

IUPAC Name

dodecan-1-ol

Molecular Weight

186.33

Molecular Formula

C12H26O

Canonical SMILES

CCCCCCCCCCCCO

InChI

InChI=1S/C12H26O/c1-2-3-4-5-6-7-8-9-10-11-12-13/h13H,2-12H2,1H3

InChI Key

LQZZUXJYWNFBMV-UHFFFAOYSA-N

Boiling Point

260-262 °C (lit.)

Melting Point

22-26 °C (lit.)

Flash Point

260 °F (USCG, 1999);260 °F (127 °C) (Closed cup);121 °C c.c.

Purity

99%+

Density

0.831 at 75.2 °F (USCG, 1999);0.8309 at 24 °C/4 °C;0.8309 AT 24 °C/4 °C;Density (at 24 °C): 0.83 g/cm³;Relative density of the vapour/air-mixture at 20 °C (air = 1): 1.00;0.830-0.836

Solubility

2.15e-05 M;0.004 mg/mL at 25 °C;In water, 4 mg/L at 25 °C;Soluble in ethanol, ether; slightly soluble in benzene;Soluble in two parts of 70% alcohol;SOL IN ALCOHOL & ETHER; INSOL IN WATER;Insoluble;Solubility in water, g/l at 25 °C: 0.004 (very poor);soluble in most fixed oils, propylene glycol; insoluble in glycerin, water;1 ml in 3 ml 70% alcohol; remains clear to 10 ml (in ethanol)

Appearance

Solid

Storage

Room temperature

Color/Form

Leaflets from dilute alcohol;COLORLESS LIQ AT ROOM TEMP; CRYSTALLINE OR FLAKES BELOW 20 °C;Colorless solid;CRYSTALLINE SOLID

Complexity

81.2

Covalently-Bonded Unit Count

EC Number

203-982-0;278-306-0;271-359-0

Exact Mass

186.198365g/mol

Formal Charge

Hazard Statements

Xi,N

Heat of Vaporization

90.8 kJ/mol at 25 °C

Heavy Atom Count

ICSC Number

1765

Log P

5.13 (LogP);5.13;log Kow = 5.13;5.13;5.4

MeSH Entry Terms

1 Dodecanol;1-Dodecanol;Alcohol, Dodecyl;Alcohol, Lauryl;Alcohol, n-Dodecyl;Dodecanol;Dodecyl Alcohol;Lauryl Alcohol;n Dodecyl Alcohol;n-Dodecyl Alcohol

Monoisotopic Mass

186.198365g/mol

NSC Number

3724

Odor

CHARACTERISTIC FATTY ODOR; UNPLEASANT AT HIGH CONCN BUT DELICATE & FLORAL ON DILUTION;Fatty repulsive odor

Other Experimental

BP: 235.7 °C at 400 mm Hg; 213 °C at 200 mm Hg; 192 °C at 100 mm Hg; 177.8 °C at 60 mm Hg; 167.2 °C at 40 mm Hg; 150 °C at 20 mm Hg; 134.7 °C at 10 mm Hg; 120.2 °C at 5 mm Hg; 91.0 °C at 1.0 mm Hg;Congealing point greater than 21 °C; acid value not more than 1;Conversion factor: 1 mg/L= 131.3 ppm; 1 ppm= 7.62 mg/cu m at 25 °C, 760 mm Hg;Index of refraction: 0.8201 at 40 °C/4 °C; 0.7781 at 99 °C/4 °C;Liquid molar volume = 0.224405 cu m/kmol;Heat of formation = -4.4426X10+8 J/kmol;Heat of fusion = 3.1380X10+7 J/kmol (at melting pt);Henry's Law constant = 5.186X10-5 atm-cu m/mol at 25 °C;Hydroxyl radical reaction rate constant = 1.8X10-11 cu cm/molec-sec at 25 °C (est);CONVERSION FACTORS: 1 MG/L= 131.3 PPM; 1 PPM= 7.62 MG/CU M AT 25 °C, 760 MM HG

Refractive Index

Index of refraction: 0.8309 at 24 °C/4 °C (liq);INDEX OF REFRACTION: 1.4400-1.4440 AT 20 °C/D;1.440-1.444

Rotatable Bond Count

RTECS Number

JR5775000

Safety Description

61-37/39-29-26-60-36

Supplemental Hazard Statements

H319-H410-H315-H400-H320-H371

UNII

178A96NLP2

UN Number