Linalyl acetoacetate

Base Information

• Chemical Name: Linalyl acetoacetate
• CAS No.: 25456-03-5
• Molecular Formula: C14H22O3
• Molecular Weight: 238.327
• Hs Code.: 2918300090
• DSSTox Substance ID: DTXSID60472906
• Nikkaji Number: J24.739A
• Mol file: 25456-03-5.mol

Synonyms:linalyl acetoacetate;25456-03-5;SCHEMBL3162151;DTXSID60472906;ZANSWOBXLYAUHS-UHFFFAOYSA-N;3,7-dimethyl-1,6octadien-3-yl 3-oxo-butyrate;3,7-dimethyl-1,6-octadien-3-yl 3-oxo-butyrate

Chemical Property of Linalyl acetoacetate

Chemical Property:

• PSA: 43.37000
• LogP: 3.19980
• XLogP3: 3.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 8
• Exact Mass: 238.15689456
• Heavy Atom Count: 17
• Complexity: 324

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(=CCCC(C)(C=C)OC(=O)CC(=O)C)C