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Substance Name: Dicetyl phosphate
RN: 2197-63-9
UNII: 2V6E5WN99N
InChIKey: RNPXCFINMKSQPQ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C32-H67-O4-P

Molecular Weight

  • 546.851
 
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Names and Synonyms

Name of Substance

  • 1-Hexadecanol, hydrogen phosphate
  • Dicetyl phosphate
  • Dicetylphosphate
  • Phosphoric acid, dihexadecyl ester

Synonyms

  • 1-Hexadecanol, hydrogen phosphate
  • 4-01-00-01880 (Beilstein Handbook Reference)
  • Bis(hexadecyl) phosphate
  • BRN 1717117
  • Di-n-hexadecyl phosphate
  • Dicetyl hydrogen phosphate
  • Dicetyl phosphate
  • Dicetylphosphoric acid
  • Dihexadecyl hydrogen phosphate
  • Dihexadecyl phosphate
  • EINECS 218-594-7
  • NSC 12429
  • Phosphoric acid, dihexadecyl ester
  • UNII-2V6E5WN99N

Systematic Names

  • 1-Hexadecanol, 1,1'-(hydrogen phosphate)
  • 1-Hexadecanol, hydrogen phosphate
  • Dihexadecyl hydrogen phosphate

Registry Numbers

CAS Registry Number

  • 2197-63-9

FDA UNII

  • 2V6E5WN99N

Related Registry Number

  • 17026-47-0 (potassium salt)

System Generated Number

  • 0002197639

Structure Descriptors

InChI

1S/C32H67O4P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-35-37(33,34)36-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h3-32H2,1-2H3,(H,33,34)

InChIKey

RNPXCFINMKSQPQ-UHFFFAOYSA-N

Smiles

O=P(OCCCCCCCCCCCCCCCC)(OCCCCCCCCCCCCCCCC)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD intraperitoneal > 500mg/kg (500mg/kg)   "Summary Tables of Biological Tests," National Research Council Chemical-Biological Coordination Center. Vol. 6, Pg. 373, 1954.