2-Butenoic acid, 2-methyl-, 3-methylpentyl ester, (2E)-

Base Information

• Chemical Name: 2-Butenoic acid, 2-methyl-, 3-methylpentyl ester, (2E)-
• CAS No.: 61692-81-7
• Molecular Formula: C11H20 O2
• Molecular Weight: 184.2753
• European Community (EC) Number: 262-904-3
• DSSTox Substance ID: DTXSID70886454
• Nikkaji Number: J279.691K
• Mol file: 61692-81-7.mol

Synonyms:61692-81-7;2-Butenoic acid, 2-methyl-, 3-methylpentyl ester, (2E)-;3-Methylpentyl 2-methylcrotonate;EINECS 262-904-3;2-Butenoic acid, 2-methyl-, 3-methylpentyl ester, (E);2-Butenoic acid, 2-methyl-, 3-methylpentyl ester, (E)-;3-methyl pentyl tiglate;Tiglic acid 3-methylpentyl;SCHEMBL873123;DTXSID70886454

Chemical Property of 2-Butenoic acid, 2-methyl-, 3-methylpentyl ester, (2E)-

Chemical Property:

• Vapor Pressure: 0.0693mmHg at 25°C
• Boiling Point: 229.5°C at 760 mmHg
• Flash Point: 84.6°C
• Density: 0.888g/cm³
• XLogP3: 3.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 6
• Exact Mass: 184.146329876
• Heavy Atom Count: 13
• Complexity: 183

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCC(C)CCOC(=O)C(=CC)C
• Isomeric SMILES: CCC(C)CCOC(=O)/C(=C/C)/C