Identità

1-Octyn-3-ol, (3S)-

Mhux elenkat · C8H14O

01Identità

Lazychem IDLC-96546
CAS RNMhux elenkat
PubChem CID2734534
Molecular formulaC8H14O
Molecular weight126.20 g/mol
IUPAC name(3S)-oct-1-yn-3-ol
InChIKeyVUGRNZHKYVHZSN-MRVPVSSYSA-N

02Struttura u stereokimika

2D structurePubChem CID 2734534
Two-dimensional chemical structure of 1-Octyn-3-ol, (3S)-
Two-dimensional structure for the PubChem identity linked to this record. Confirm the identifiers before analytical use.

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

Defined stereocentres1
Ring count0
Secondary amines0
Tertiary amines0
SMILESCCCCC[C@@H](C#C)O
InChIMhux elenkat

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.

04Status fl-Indja

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

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