Идентичност

Phenprocoumon

Не е посочено · C18H16O3

01Идентичност

Lazychem IDLC-57625
CAS RNНе е посочено
PubChem CID54680692
Molecular formulaC18H16O3
Molecular weight280.3 g/mol
IUPAC name4-hydroxy-3-(1-phenylpropyl)chromen-2-one
InChIKeyDQDAYGNAKTZFIW-UHFFFAOYSA-N

02Структура и стереохимия

2D structurePubChem CID 54680692
Two-dimensional chemical structure of Phenprocoumon
Two-dimensional structure for the PubChem identity linked to this record. Confirm the identifiers before analytical use.

The parsed structure contains 3 rings, includes aromatic atoms, includes aliphatic carbon. These statements are calculated from the published structure string.

Defined stereocentres0
Ring count3
Secondary amines0
Tertiary amines0
SMILESCCC(C1=CC=CC=C1)C2=C(C3=CC=CC=C3OC2=O)O
InChIНе е посочено

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.

04Статус в Индия

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

05Имена и връзки

API и изходно лекарство

Не е посочено

Имена и връзки

    Примеси и сродни съединения

      06Източници