2,2,4-Trimethyl-1,3-pentanediol 1-monoisobutyrate

Catalog No. :
ACDMIF287
CAS No. :
25265-77-4
Molecular Formula :
C24H48O6
Molecular Weight :
432.64

IUPAC Name:1-hydroxy-2,2,4-trimethylpentan-3-yl isobutyrate--3-hydroxy-2,2,4-trimethylpentyl isobutyrate (1/1)

2,2,4-Trimethyl-1,3-pentanediol 1-monoisobutyrate structure diagram
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Product Information

Product Name2,2,4-Trimethyl-1,3-pentanediol 1-monoisobutyrate
IUPAC Name1-hydroxy-2,2,4-trimethylpentan-3-yl isobutyrate--3-hydroxy-2,2,4-trimethylpentyl isobutyrate (1/1)
MDL No.MFCD00148967
Molecular FormulaC24H48O6
Molecular Weight432.64
SMILESCC(C)C(O)C(COC(C(C)C)=O)(C)C.CC(C(OC(C(C)(CO)C)C(C)C)=O)C
InChI KeyNDEMTTVWCLWAQG-UHFFFAOYSA-N
Synonym3-hydroxy-2,2,4-trimethylpentylisobutyrate | EINECS 201-049-2 | Texanolesteralcohol | Tox21_200148 | 2,2,4-TRIMETHYL-1,3-PENTANEDIOL 1-ISOBUTYRATE | 3-hydroxy-2,2,4-trimethylpentyl 2-methylpropionate | 3-Hydroxy-2,2,4-trimethylpentyl isobutyrate | MFCD001
CAS No.25265-77-4
PubChem CID6490

Safety Data

Pictogram
Harmful or irritant
Signal Word
Warning
Hazard Statement(s)
H315-H319-H335-H412
Precautionary Statement(s)
P261-P273-P305+P351+P338

Synthetic Route by SureRoute

1. ACDMIF287 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. reactant_1 route compound structure diagram
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  3. reactant_2 route compound structure diagram
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  4. Then
  5. ACDMIF287 route product structure diagram
    ACDMIF28725265-77-4
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2. ACDMIF287 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. reactant_1 route compound structure diagram
    --
  2. Then
  3. ACDMIF287 route product structure diagram
    ACDMIF28725265-77-4
Inquiry

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