4-(Isopropyl)cyclohexadiene-1-ethyl formate

Base Information

• Chemical Name: 4-(Isopropyl)cyclohexadiene-1-ethyl formate
• CAS No.: 68683-20-5
• Molecular Formula: C12H18O2
• Molecular Weight: 194.30
• European Community (EC) Number: 272-066-0
• DSSTox Substance ID: DTXSID101019291
• Wikidata: Q81999466
• Mol file: 68683-20-5.mol

Synonyms:4-(Isopropyl)cyclohexadiene-1-ethyl formate;2-(4-Isopropylcyclohexadienyl)ethyl formate;68683-20-5;Isobergamate;1,?-Cyclohexadiene-1-ethanol, 4-(1-methylethyl)-, formate;Menthadienyl formiate;Menthadiene-7-methyl formate;1891096-88-0;EINECS 272-066-0;Formic acid, (menthadien-7-methanyl) ester;4-(1-Methylethyl)cyclohexadiene-1-ethyl formate;4-(1-Methylethyl)cyclohexadiene-1-ethanol formate;Cyclohexadieneethanol, 4-(1-methylethyl)-, formate;Cyclohexadiene-1-ethanol, 4-(1-methylethyl)-, formate;SCHEMBL1773464;DTXSID101019291;W-111368;2-(4-Isopropylcyclohexa-1,4-dien-1-yl)ethyl formate;1,?-Cyclohexadiene-1-ethanol, 4-(1-methylethyl)-, 1-formate;1,4-Cyclohexadiene-1-ethanol, 4-(1-methylethyl)-, 1-formate

Chemical Property of 4-(Isopropyl)cyclohexadiene-1-ethyl formate

Chemical Property:

• Vapor Pressure: 0.00663mmHg at 25°C
• Boiling Point: 271°Cat760mmHg
• Flash Point: 120.4°C
• Density: 0.976g/cm³
• XLogP3: 2.6
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 5
• Exact Mass: 194.130679813
• Heavy Atom Count: 14
• Complexity: 249

Purity/Quality:

98% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)C1=CCC(=CC1)CCOC=O