(3S,6S)-3,6-OCTANEDIOL Chemical Properties

Melting point:

49-51°C

alpha 

+15° (c 10, ethanol)

Boiling point:

243.79°C (rough estimate)

Density 

0.9636 (rough estimate)

refractive index 

1.4411 (estimate)

storage temp. 

under inert gas (nitrogen or Argon) at 2–8 °C

form 

crystal

pka

14.86±0.20(Predicted)

color 

colorless

InChI

InChI=1S/C8H18O2/c1-3-7(9)5-6-8(10)4-2/h7-10H,3-6H2,1-2H3/t7-,8-/m0/s1

InChIKey

BCKOQWWRTRBSGR-YUMQZZPRSA-N

SMILES

CC[C@H](O)CC[C@@H](O)CC

CAS DataBase Reference

136705-66-3

Safety Information

Safety Statements 

24/25

MSDS

• Language:English Provider:ACROS

(3S,6S)-3,6-OCTANEDIOL Usage And Synthesis

Chemical Properties

white needle-like crystals

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