Identita

Perillaldehyde, (-)-

Neuvedeno · C10H14O

01Identita

Lazychem IDLC-97430
CAS RNNeuvedeno
PubChem CID2724159
Molecular formulaC10H14O
Molecular weight150.22 g/mol
IUPAC name(4S)-4-prop-1-en-2-ylcyclohexene-1-carbaldehyde
InChIKeyRUMOYJJNUMEFDD-SNVBAGLBSA-N

02Struktura a stereochemie

2D structurePubChem CID 2724159
Two-dimensional chemical structure of Perillaldehyde, (-)-
Two-dimensional structure for the PubChem identity linked to this record. Confirm the identifiers before analytical use.

The parsed structure contains 1 ring, includes aliphatic carbon, has 1 defined stereocentre. These statements are calculated from the published structure string.

Defined stereocentres1
Ring count1
Secondary amines0
Tertiary amines0
SMILESCC(=C)[C@H]1CCC(=CC1)C=O
InChINeuvedeno

03Stereochemistry

The published structure contains 1 defined and 0 unassigned tetrahedral stereocentre. The exact wedge and dash depiction is shown above.

Defined centres1Structure assigned
Unassigned centres0Structure unspecified
Assignment statusFully assignedExact published identity
Tetrahedral upper bound≤ 2Before 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.

04Stav v Indii

Exact-compound status is evaluated only against the published name and CAS number. Confirm the current official instrument before a regulatory decision.

05Názvy a vztahy

API a mateřské léčivo

Neuvedeno

Názvy a vztahy

    Nečistoty a související sloučeniny

      06Zdroje