Chemical identity

Pentaerythritol bis(3,5-di-tert-butyl-4-hydroxyhydrocinnamate)

CAS 36913-60-7 · C39H60O8

01Identity

Identifiers and names for this exact compound. Empty fields are left unassigned.

Lazychem IDLC-26189
PubChem CID87747876
NamePentaerythritol bis(3,5-di-tert-butyl-4-hydroxyhydrocinnamate)
CAS RN36913-60-7
Molecular formulaC39H60O8
Molecular weight656.90 g/mol
IUPAC name2,2-bis(hydroxymethyl)propane-1,3-diyl bis(3-(3,5-di-tert-butyl-4-hydroxyphenyl)propanoate)
InChIKeyMFSAJLWSXLIOHZ-UHFFFAOYSA-N

02Structure identifiers

2D structurePubChem CID 87747876
Two-dimensional chemical structure of Pentaerythritol bis(3,5-di-tert-butyl-4-hydroxyhydrocinnamate), CAS 36913-60-7
Two-dimensional structure for the PubChem identity linked to this record. Confirm the identifiers before analytical use.

The parsed structure contains 2 rings, includes aromatic atoms, includes aliphatic carbon. These statements are calculated from the published structure string.

Defined stereocentres0
Unassigned stereocentres0
Ring count2
Secondary amines0
Tertiary amines0
N-methyl amine sites0
SMILESCC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CCC(=O)OCC(CO)(CO)COC(=O)CCC2=CC(=C(C(=C2)C(C)(C)C)O)C(C)(C)C
InChINot listed
Formula from structureC39H60O8
Molecular weight from structure656.90 g/mol

03India status for this compound

These results apply only to this exact compound name and CAS number. Confirm the current official instruments before making a regulatory decision.

NDPS / RCSNO EXACT MATCH FOUNDCAS 36913-60-7 has no exact match in the reviewed published schedule.
SCOMETNO EXACT REVIEWED CAS MATCHCAS 36913-60-7 has no exact match in the reviewed SCOMET list.
Review date2026-08-01Recheck the current official instruments for the material, concentration, activity and date in question.

04Names and relationships

Associated parent compound

Propofol

View API and impurity family

Other names

  • Propofol Impurity 27
  • Pentaerythritol bis(3,5-di-tert-butyl-4-hydroxyhydrocinnamate)
  • 36913-60-7
  • 2RS3YUM82C
  • Neopentylglycol bis(3-(3,5-di-tert-butyl-4-hydroxyphenyl)propionate)
  • Benzenepropanoic acid, 3,5-bis(1,1-dimethylethyl)-4-hydroxy-, 1,1'-(2,2-bis(hydroxymethyl)-1,3-propanediyl) ester
  • Benzenepropanoic acid, 3,5-bis(1,1-dimethylethyl)-4-hydroxy-, 2,2-bis(hydroxymethyl)-1,3-propanediyl ester
  • RefChem:859736
  • 998-548-7
  • 2,2-bis(hydroxymethyl)propane-1,3-diyl bis(3-(3,5-di-tert-butyl-4-hydroxyphenyl)propanoate)
  • UNII-2RS3YUM82C
  • Propofol Impurity N8

Related records from the same parent family

05Documented history

Dated discovery, occurrence, use and issue claims are published only when a suitable primary or government source is available.

No dated history available

No verified discovery, first report, occurrence, use or issue event is currently available for this identity.

06Sources