Identitāte

Penconazole

Nav norādīts · C13H15Cl2N3

01Identitāte

Lazychem IDLC-118419
CAS RNNav norādīts
PubChem CID91693
Molecular formulaC13H15Cl2N3
Molecular weight284.18 g/mol
IUPAC name1-[2-(2,4-dichlorophenyl)pentyl]-1,2,4-triazole
InChIKeyWKBPZYKAUNRMKP-UHFFFAOYSA-N

02Struktūra un stereoķīmija

2D structurePubChem CID 91693
Two-dimensional chemical structure of Penconazole
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, contains at least one halogen atom. These statements are calculated from the published structure string.

Defined stereocentres0
Ring count2
Secondary amines0
Tertiary amines0
SMILESCCCC(CN1C=NC=N1)C2=C(C=C(C=C2)Cl)Cl
InChINav norādīts

03Stereochemistry

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

Defined centres0Structure assigned
Unassigned centres1Structure unspecified
Assignment statusUnassignedExact 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.

04Statuss Indijā

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

05Nosaukumi un saistības

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