1-Azulenecarboxylic acid, 3-ethyl-7-(1-methylethyl)-, methyl ester

Base Information

• Chemical Name: 1-Azulenecarboxylic acid, 3-ethyl-7-(1-methylethyl)-, methyl ester
• CAS No.: 99909-63-4
• Molecular Formula: C₁₇H₂₀O₂
• Molecular Weight: 256.345
• DSSTox Substance ID: DTXSID00440427
• Nikkaji Number: J1.642.620B
• Mol file: 99909-63-4.mol

Synonyms:99909-63-4;1-Azulenecarboxylic acid, 3-ethyl-7-(1-methylethyl)-, methyl ester;SCHEMBL10414616;DTXSID00440427;3-Ethyl-7-isopropyl-1-azulenecarboxylic acid methyl ester

Chemical Property of 1-Azulenecarboxylic acid, 3-ethyl-7-(1-methylethyl)-, methyl ester

Chemical Property:

• XLogP3: 4.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 4
• Exact Mass: 256.146329876
• Heavy Atom Count: 19
• Complexity: 310

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCC1=CC(=C2C1=CC=CC(=C2)C(C)C)C(=O)OC