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Substance Name: Acetic acid, chloro-, compd. with 1-tetradecanamine (1:1)
RN: 78961-21-4
InChIKey: GZZFYDVDUNYQST-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C14-H31-N.C2-H3-Cl-O2

Molecular Weight

  • 307.903
 
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Names and Synonyms

Synonyms

  • 1-Tetradecanamine compd. with chloroacetic acid (1:1)
  • Chloroacetic acid compd. with 1-tetradecanamine (1:1)
  • Tetradecylamine, chloroacetate
  • Tetradecylammonium chloroacetate

Systematic Name

  • Acetic acid, chloro-, compd. with 1-tetradecanamine (1:1)

Registry Numbers

CAS Registry Number

  • 78961-21-4

System Generated Number

  • 0078961214

Molecular Formulas

Molecular Formula

  • C14-H31-N.C2-H3-Cl-O2

Molecular Formula Fragments

  • C14-H31-N
  • C2-H3-Cl-O2
  • COMPONENT

Structure Descriptors

InChI

1S/C14H31N.C2H3ClO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15;3-1-2(4)5/h2-15H2,1H3;1H2,(H,4,5)

InChIKey

GZZFYDVDUNYQST-UHFFFAOYSA-N

Smiles

C(=O)(CCl)O.C(CCCCCCC)CCCCCCN

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 667mg/kg (667mg/kg) SKIN AND APPENDAGES (SKIN): "DERMATITIS, IRRITATIVE: AFTER SYSTEMIC EXPOSURE" Pharmaceutical Chemistry Journal Vol. 15, Pg. 383, 1981.