2-Methylbutyl angelate

Base Information

• Chemical Name: 2-Methylbutyl angelate
• CAS No.: 97752-27-7
• Molecular Formula: C10H18 O2
• Molecular Weight: 170.24872
• European Community (EC) Number: 262-900-1,262-903-8,307-789-3
• DSSTox Substance ID: DTXSID701314184
• Nikkaji Number: J213.411J
• Mol file: 97752-27-7.mol

Synonyms:2-Methylbutyl angelate;61692-77-1;EINECS 262-900-1;2-methylbutyl (Z)-2-methylbut-2-enoate;2-Methylbutyl 2-methyl-2-butenoate (Z)-;EINECS 307-789-3;2-METHYLBUTYL 2-METHYLISOCROTONATE;97752-27-7;2-Methylbutyl (E)-(-)-2-methylisocrotonate;2-Butenoic acid, 2-methyl-, 2-methylbutyl ester, (Z)-;Butyl angelate 2-methyl-1-;SCHEMBL10605319;Angelic acid 2-methylbutyl ester;DEJJNOHKWLTTKE-TWGQIWQCSA-N;DTXSID701314184;2-Methylbutyl(E)-(+)-2-methylisocrotonate;2-Methylbutyl(E)-(-)-2-methylisocrotonate

Chemical Property of 2-Methylbutyl angelate

Chemical Property:

• Vapor Pressure: 0.206mmHg at 25°C
• Refractive Index: 1.437
• Boiling Point: 209.2°Cat760mmHg
• Flash Point: 75.4°C
• Density: 0.891g/cm³
• XLogP3: 3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 5
• Exact Mass: 170.130679813
• Heavy Atom Count: 12
• Complexity: 171

Purity/Quality:

98%Min ^*data from raw suppliers

Safty Information:

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MSDS Files:

Useful:

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

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