Name: Name:7-Methoxy-7-oxoheptanoic acid
Brand: AABLOCKS
SKU: AA0028G8
Rating: 90 (10 reviews)

Technical Information

Catalog Number: AA0028G8

Chemical Name: 7-Methoxy-7-oxoheptanoic acid

CAS Number: 20291-40-1

Molecular Formula: C8H14O4

Molecular Weight: 174.1944

MDL Number: MFCD00040445

SMILES: COC(=O)CCCCCC(=O)O

Properties

Complexity: 153

Covalently-Bonded Unit Count: 1

Defined Atom Stereocenter Count: 0

Defined Bond Stereocenter Count: 0

Formal Charge: 0

Heavy Atom Count: 12

Hydrogen Bond Acceptor Count: 4

Hydrogen Bond Donor Count: 1

Isotope Atom Count: 0

Rotatable Bond Count: 7

Undefined Atom Stereocenter Count: 0

Undefined Bond Stereocenter Count: 0

XLogP3: 1.1

Downstream Synthesis Route

110-86-1

67-56-1

3878-55-5

54322-10-0

124-41-4

505-48-6

627-93-0

20291-40-1

[1]CollectionofCzechoslovakChemicalCommunications,1954,vol.19,p.716

111-16-0

1732-08-7

20291-40-1

[1]Patent:US5952492,1999,A

[2]ChemischeBerichte,1939,vol.72,p.455

[3]JournaloftheChemicalSociety.PerkintransactionsI,1980,p.2346-2352

1732-08-7

20291-40-1

[1]JournaloftheChemicalSociety.PerkintransactionsI,1993,p.1713-1714

[2]TetrahedronLetters,2020,vol.61

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[6]JournaloftheChemicalSociety,1935,p.290,291

20291-40-1

35444-47-4

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108-22-5

20291-40-1

148114-06-1

[1]JournaloftheChemicalSociety.PerkintransactionsI,1993,p.2639-2650

[2]JournaloftheChemicalSociety.Chemicalcommunications,1993,p.410-412

20291-40-1 | 7-Methoxy-7-oxoheptanoic acid