Chemical identity

Bis(4-ethylbenzylidene)sorbitol

CAS 79072-96-1 · C24H30O6

01Identity

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

Lazychem IDLC-08342
PubChem CID9866479
NameBis(4-ethylbenzylidene)sorbitol
CAS RN79072-96-1
Molecular formulaC24H30O6
Molecular weight414.49 g/mol
IUPAC name(1Z,3R,4S,5S,6S,7Z)-1,8-bis(4-ethylphenyl)octa-1,7-diene-2,3,4,5,6,7-hexaol
InChIKeyRPMMDFYGVMKCJU-UHFFFAOYSA-N

02Structure identifiers

2D structurePubChem CID 9866479
Two-dimensional chemical structure of Bis(4-ethylbenzylidene)sorbitol, CAS 79072-96-1
Two-dimensional structure for the PubChem identity linked to this record. Confirm the identifiers before analytical use.

The parsed structure contains 4 rings, includes aromatic atoms, includes aliphatic carbon. These statements are calculated from the published structure string.

Defined stereocentres0
Unassigned stereocentres6
Ring count4
Secondary amines0
Tertiary amines0
N-methyl amine sites0
SMILESCCC1=CC=C(C=C1)C2OCC3C(O2)C(OC(O3)C4=CC=C(C=C4)CC)C(CO)O
InChINot listed
Formula from structureC24H30O6
Molecular weight from structure414.49 g/mol

03Stereochemistry

The published structure contains 0 defined and 6 unassigned tetrahedral stereocentres. The exact wedge and dash depiction is shown above.

Defined centres0Structure assigned
Unassigned centres6Structure unspecified
Assignment statusUnassignedExact published identity
Tetrahedral upper bound≤ 64Before symmetry reduction

Published same-connectivity configurations

1 record

These records have the same connectivity, molecular formula and protonation layer, but a different complete InChIKey stereochemical layer. Only separately structure-linked records are shown.

No additional structure-linked configuration with the same connectivity is currently present in the LazyChem dataset.

Scope: The mathematical 2^n value is only an upper bound. Symmetry and other stereogenic elements can change the number of distinct stereoisomers. A hypothetical configuration is not published as a compound record without a verified structure identity.

04India 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 79072-96-1 has no exact match in the reviewed published schedule.
SCOMETNO EXACT REVIEWED CAS MATCHCAS 79072-96-1 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.

05Names and relationships

Associated parent compound

Chemical

View associated product family

Other names

  • 2,6-Bis(4-ethylphenyl)perhydro-1,3,5,7-tetraoxanaphth-4-ylethane-1,2-diol
  • Hexitol, 1,3:2,4-bis-O-[(4-ethylphenyl)methylene]-
  • EC 406-176-9
  • 1,3:2,4-Bis-O-[(4-ethylphenyl)methylene]hexitol
  • RefChem:445212
  • 406-176-9
  • 79072-96-1
  • 1-[2,6-bis(4-ethylphenyl)-4,4a,8,8a-tetrahydro-[1,3]dioxino[5,4-d][1,3]dioxin-4-yl]ethane-1,2-diol
  • bis(4-ethylbenzylidene)sorbitol
  • SCHEMBL12064701
  • DTXSID50893646
  • RPMMDFYGVMKCJU-UHFFFAOYSA-N

Related records from the same parent family

06Documented 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.

07Sources