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Substance Name: Cyclododecalactam
RN: 947-04-6
UNII: UB8VFC953G
InChIKey: JHWNWJKBPDFINM-UHFFFAOYSA-N

Molecular Formula

  • C12-H23-N-O

Molecular Weight

  • 197.32
 
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Names and Synonyms

Name of Substance

  • Cyclododecalactam

Synonyms

  • 1-Aza-2-cyclotridecanone
  • 2-Azacyclotridecanone
  • 2-Oxo-dodecamethylenimine
  • 5-21-06-00566 (Beilstein Handbook Reference)
  • BRN 0122031
  • Cyclododecalactam
  • Dodecanoic acid, 12-amino-, lactam
  • Dodecyllactam
  • EC 213-424-8
  • EINECS 213-424-8
  • HSDB 5774
  • Laurin lactam
  • Laurinolactam
  • Lauryl lactam
  • NSC 77100
  • omega-Dodecalactam
  • omega-Dodecanolactam
  • omega-Laurolactam
  • UNII-UB8VFC953G

Systematic Names

  • Azacyclotridecan-2-one
  • Dodecane-12-lactam

Superlist Name

  • Azacyclotridecan-2-one

Registry Numbers

CAS Registry Number

  • 947-04-6

FDA UNII

  • UB8VFC953G

Other Registry Numbers

  • 115296-76-9
  • 125081-69-8
  • 148308-40-1
  • 161865-23-2
  • 70099-82-0

System Generated Number

  • 0000947046

Structure Descriptors

InChI

1S/C12H23NO/c14-12-10-8-6-4-2-1-3-5-7-9-11-13-12/h1-11H2,(H,13,14)

InChIKey

JHWNWJKBPDFINM-UHFFFAOYSA-N

Smiles

C1(CCCCCCCCCCCN1)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 500mg/kg (500mg/kg) BEHAVIORAL: TREMOR

BEHAVIORAL: ALTERED SLEEP TIME (INCLUDING CHANGE IN RIGHTING REFLEX)
Journal of Pharmaceutical Sciences. Vol. 60, Pg. 1058, 1971.

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 150-153 deg C   EXP
log P (octanol-water) 2.92 (none)   EXP
Water Solubility 290 mg/L 25 EXP
Vapor Pressure 7.31E-06 mm Hg 25 EST
Henry's Law Constant 1.39E-07 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 2.69E-11 cm3/molecule-sec 25 EST

Physical property data is provided to ChemIDplus by SRC, Inc.