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Substance Name: Pentachlorophenol dehydroabietylamine salt
RN: 35109-57-0
UNII: D0Q6F9QA0X
InChIKey: FQHFSZCYOUJICQ-WFBUOHSLSA-N

Molecular Formula

  • C20-H31-N.C6-H-Cl5-O

Molecular Weight

  • 551.8098
 
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Names and Synonyms

Results Name

  • Pentachlorophenol dehydroabietylamine salt

Name of Substance

  • Dehydroabietylammonium pentachlorophenoxide

Synonyms

  • Caswell No. 277A
  • Dehydroabietylammonium pentachlorophenoxide
  • EINECS 252-371-5
  • EPA Pesticide Chemical Code 004202
  • Pentachlorophenol dehydroabietylamine salt
  • UNII-D0Q6F9QA0X

Systematic Names

  • Pentachlorophenol, compound with (1R-(1alpha,4abeta,10aalpha))-1,2,3,4,4a,9,10,10a-octahydro-7-isopropyl-1,4a-dimethylphenanthrene-1-methylamine (1:1)
  • Phenol, pentachloro-, compd. with (1R,4aS,10aR)-1,2,3,4,4a,9,10,10a-octahydro-1,4a-dimethyl-7-(1-methylethyl)-1-phenanthrenemethanamine (1:1)

Registry Numbers

CAS Registry Number

  • 35109-57-0

FDA UNII

  • D0Q6F9QA0X

System Generated Number

  • 0035109570

Molecular Formulas

Molecular Formula

  • C20-H31-N.C6-H-Cl5-O

Molecular Formula Fragments

  • C20-H31-N
  • C6-H-Cl5-O
  • COMPONENT

Structure Descriptors

InChI

1S/C20H31N.C6HCl5O/c1-14(2)15-6-8-17-16(12-15)7-9-18-19(3,13-21)10-5-11-20(17,18)4;7-1-2(8)4(10)6(12)5(11)3(1)9/h6,8,12,14,18H,5,7,9-11,13,21H2,1-4H3;12H/t18-,19-,20+;/m0./s1

InChIKey

FQHFSZCYOUJICQ-WFBUOHSLSA-N

Smiles

CC(C)c1ccc2c(CC[C@H]3[C@](C)(CN)CCC[C@]23C)c1.Oc4c(Cl)c(Cl)c(Cl)c(Cl)c4Cl