Identiteta

3-(Hydroxymethyl)cyclohexanone

Ni navedeno · C7H12O2

01Identiteta

Lazychem IDLC-75762
CAS RNNi navedeno
PubChem CID12201678
Molecular formulaC7H12O2
Molecular weight128.17 g/mol
IUPAC name3-(hydroxymethyl)cyclohexan-1-one
InChIKeyOTZGKTIHFHBTGZ-UHFFFAOYSA-N

02Struktura in stereokemija

2D structurePubChem CID 12201678
Two-dimensional chemical structure of 3-(Hydroxymethyl)cyclohexanone
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. These statements are calculated from the published structure string.

Defined stereocentres0
Ring count1
Secondary amines0
Tertiary amines0
SMILESC1CC(CC(=O)C1)CO
InChINi navedeno

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.

04Status v Indiji

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

05Imena in povezave

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