Identidade

Boc-D-alanine methyl ester

Não indicado · C9H17NO4

01Identidade

Lazychem IDLC-104043
CAS RNNão indicado
PubChem CID637612
Molecular formulaC9H17NO4
Molecular weight203.24 g/mol
IUPAC namemethyl (2R)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate
InChIKeyGJDICGOCZGRDFM-ZCFIWIBFSA-N

02Estrutura e estereoquímica

2D structurePubChem CID 637612
Two-dimensional chemical structure of Boc-D-alanine methyl ester
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
SMILESC[C@H](C(=O)OC)NC(=O)OC(C)(C)C
InChINão indicado

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

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.

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

Não indicado

Nomes e relações

    Impurezas e compostos relacionados

      06Fontes