Methyl 7-methyloctanoate

Base Information

• Chemical Name: Methyl 7-methyloctanoate
• CAS No.: 93409-96-2
• Molecular Formula: C10H20 O2
• Molecular Weight: 172.2646
• European Community (EC) Number: 297-320-8
• DSSTox Substance ID: DTXSID80918457
• Nikkaji Number: J1.737.711F
• Wikidata: Q82890562
• Mol file: 93409-96-2.mol

Synonyms:methyl 7-methyloctanoate;5129-53-3;METHYL ISONONANOATE;EINECS 297-320-8;93409-96-2;Octanoic acid, 7-methyl, methyl ester;6-Methyl-heptanecarboxylicacidmethylester;Octanoic acid, 7-methyl-, methyl ester;methyl-7-methyl-octanoate;SCHEMBL5056126;DTXSID80918457;IEHIOXQFWRLVGR-UHFFFAOYSA-N;7-methyloctanoic acid methyl ester;AKOS006271593;AM20120585;FT-0693803

Chemical Property of Methyl 7-methyloctanoate

Chemical Property:

• XLogP3: 3.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 7
• Exact Mass: 172.146329876
• Heavy Atom Count: 12
• Complexity: 119

Purity/Quality:

98%Min ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC(C)CCCCCC(=O)OC