Identidade

1,2-Dinitroglycerin D5

Não indicado · C3HD5N2O7

01Identidade

Lazychem IDLC-01387
CAS RNNão indicado
PubChem CID129010186
Molecular formulaC3HD5N2O7
Molecular weight187.12 g/mol
IUPAC name3-Hydroxypropane-1,2-diyl-1,1,2,3,3-d5 dinitrate
InChIKeyGFVHBTOOPNJKLV-UXXIZXEISA-N

02Estrutura e estereoquímica

2D structurePubChem CID 129010186
Two-dimensional chemical structure of 1,2-Dinitroglycerin D5
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, contains a nitro substructure. These statements are calculated from the published structure string.

Defined stereocentres0
Ring count0
Secondary amines0
Tertiary amines0
SMILES[2H]C([2H])(O)C([2H])(O[N+]([O-])=O)C([2H])(O[N+]([O-])=O)[2H]
InChINão indicado

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.

04Estado na Índia

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

05Nomes e relações

API e fármaco de origem

Nitroglycerin

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    06Fontes