Identitate

2,5-Hexanediol, (2S,5S)-

Nu este indicat · C6H14O2

01Identitate

Lazychem IDLC-83515
CAS RNNu este indicat
PubChem CID6950288
Molecular formulaC6H14O2
Molecular weight118.17 g/mol
IUPAC name(2S,5S)-hexane-2,5-diol
InChIKeyOHMBHFSEKCCCBW-WDSKDSINSA-N

02Structură și stereochimie

2D structurePubChem CID 6950288
Two-dimensional chemical structure of 2,5-Hexanediol, (2S,5S)-
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 2 defined stereocentres. These statements are calculated from the published structure string.

Defined stereocentres2
Ring count0
Secondary amines0
Tertiary amines0
SMILESC[C@@H](CC[C@H](C)O)O
InChINu este indicat

03Stereochemistry

The published structure contains 2 defined and 0 unassigned tetrahedral stereocentres. The exact wedge and dash depiction is shown above.

Defined centres2Structure assigned
Unassigned centres0Structure unspecified
Assignment statusFully assignedExact published identity
Tetrahedral upper bound≤ 4Before symmetry reduction

Published same-connectivity configurations

2 records

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.

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.

04Statut în India

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

05Denumiri și relații

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