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Substance Name: 3-Mercaptohexyl acetate
RN: 136954-25-1
UNII: 2951Y254J9
InChIKey: GSJSVAFGVJLTNQ-UHFFFAOYSA-N

Classification Code

  • TSCA Flag P (a Commenced PMN (Premanufacture Notice) Substance)

Molecular Formula

  • C10-H18-O3-S

Molecular Weight

  • 218.3152
 
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Names and Synonyms

Name of Substance

  • 3-Mercaptohexyl acetate

Synonyms

  • (+/-)-3-Mercaptohexyl acetate
  • 3-(Acetylmercapto)hexyl acetate
  • 3-Acetylmercaptohexyl acetate [FIFH]
  • 3-Acetylthiohexyl acetate
  • 3-Acetylthiohexyl ethanoate
  • 3-Mercaptohexyl acetate, (+/-)-
  • Ethanethioic acid, S-(1-(2-(acetyloxy)ethyl)butyl) ester
  • FEMA No. 3816
  • Passiflora acetate
  • UNII-2951Y254J9

Systematic Name

  • Ethanethioic acid, S-(1-(2-(acetyloxy)ethyl)butyl) ester

Superlist Name

  • 3-Mercaptohexyl acetate

Registry Numbers

CAS Registry Number

  • 136954-25-1

FDA UNII

  • 2951Y254J9

System Generated Number

  • 0136954251

Structure Descriptors

InChI

1S/C10H18O3S/c1-4-5-10(14-9(3)12)6-7-13-8(2)11/h10H,4-7H2,1-3H3

InChIKey

GSJSVAFGVJLTNQ-UHFFFAOYSA-N

Smiles

CCCC(CCOC(=O)C)SC(=O)C