-OEChem-06231013072D

 16 15  0     0  0  0  0  0  0999 V2000
    3.4664    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000   -0.6586    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.9328   -0.6586    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7716    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0941    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6277   -0.6586    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2380   -0.6586    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3992    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.5605   -0.6586    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7044    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3052   -0.6586    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.8656   -0.6586    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1612    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.0269    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.1708   -0.6586    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.3320    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  6  1  0  0  0  0
  1 11  1  0  0  0  0
  2 13  1  0  0  0  0
  3  4  1  0  0  0  0
  3  5  1  0  0  0  0
  4  6  1  0  0  0  0
  5  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  1  0  0  0  0
 10 12  1  0  0  0  0
 11 13  1  0  0  0  0
 12 14  1  0  0  0  0
 14 15  1  0  0  0  0
 15 16  1  0  0  0  0
M  END
> <PUBCHEM_COMPOUND_ID_TYPE>
0

> <PUBCHEM_TOTAL_CHARGE>
0

> <PUBCHEM_SUBSTANCE_ID>
48423392

> <PUBCHEM_SUBSTANCE_VERSION>
2

> <PUBCHEM_EXT_DATASOURCE_NAME>
EPA DSSTox

> <PUBCHEM_EXT_DATASOURCE_REGID>
31296

> <PUBCHEM_SUBSTANCE_COMMENT>
Substance included in EPA DSSTox NTPBSI: National Toxicology Program (NTP) Bioassay On-line Database Structure-Index Locator File <a href="http://www.epa.gov/ncct/dsstox/sdf_ntpbsi.html"target="_blank">[link to DSSTox SDF Download Page]</a>
Structure Shown: tested chemical
For further information visit the NTP Study <a href="http://ntp-apps.niehs.nih.gov/ntp_tox/index.cfm?fuseaction=ntpsearch.ntpstudiesforchemical&cas_no=9002-92-0"target="_blank">Chemical Results Webpage</a>

> <PUBCHEM_SUBSTANCE_SYNONYM>
2-(dodecyloxy)ethanol
9002-92-0
Ethoxylated dodecyl alcohol

> <PUBCHEM_GENERIC_REGISTRY_NAME>
9002-92-0

> <PUBCHEM_XREF_EXT_ID>
31296

> <PUBCHEM_EXT_DATASOURCE_URL>
http://www.epa.gov/ncct/dsstox/sdf_ntpbsi.html

> <PUBCHEM_EXT_SUBSTANCE_URL>
http://ntp-apps.niehs.nih.gov/ntp_tox/index.cfm?fuseaction=ntpsearch.ntpstudiesforchemical&cas_no=9002-92-0

> <PUBCHEM_CID_ASSOCIATIONS>
24750  1

> <PUBCHEM_COORDINATE_TYPE>
1
3

$$$$