Cyclooctanone | CAS No. 502-49-8

Cyclooctanone

Basic Information

CAS Number

502-49-8

Molecular Formula

C8H14O

Molecular Weight

126.2 g/mol

AD

Basic Physical Properties

Melting Point

32-41 °C

Boiling Point

195-197 °C

Water Solubility

Soluble in water at 20°C 15g/L. Soluble in acetone, alcohol, chloroform, methanol and benzene.

Solubility

15g/l

Refractive Index

1.4694

Vapor Pressure

0.41 mmHg

C1CCCC(=O)CCC1

InChI

InChI=1S/C8H14O/c9-8-6-4-2-1-3-5-7-8/h1-7H2

InChIKey

IIRFCWANHMSDCG-UHFFFAOYSA-N

LogP

2.2998000000000003

Topological Polar Surface Area

17.07 Ų

Hydrogen Bond Donor/Acceptor

0 / 1

Complexity

86.7

Safety Information

View Safety Information

GHS Hazard Pictograms

H315H315
H319H319
H335H335

Hazard Statement

H315 Causes skin irritation
Skin corrosion/irritation
H319 Causes serious eye irritation
Serious eye damage/eye irritation
H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Hazard Class

Class 8 Class 8

Synonyms & References

English

  • DTXSID3060114
  • 502-49-8
  • UNII-Z4GO9P8SUZ
  • FT-0624240
  • NSC9475
  • CS-W007564
  • MFCD00001754
  • CHEMBL18737
  • Azelaone
  • Z4GO9P8SUZ
  • cyclo-octanone
  • Cyclooctanone, 98%
  • Cyclooctanone, Vetec(TM) reagent grade, 98%
  • F0001-1312
  • Q20054504
  • NSC-9475
  • Z104474712
  • NSC 9475
  • cyclooctanone; cyclooctan-1-one
  • CYCLOOCTANONE
  • NS00032019
  • AKOS000119617
  • InChI=1/C8H14O/c9-8-6-4-2-1-3-5-7-8/h1-7H
  • CyclooCLanone
  • 4-07-00-00049 (Beilstein Handbook Reference)
  • STR03048
  • SCHEMBL181981
  • BCP09447
  • WLN: L8VTJ
  • AMY3996
  • BRN 1280738

MDL Number

MFCD00001754

Customs Code

2914299000

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