Cyclohexyl 2-isobutyl phthalate

Base Information

• Chemical Name: Cyclohexyl 2-isobutyl phthalate
• CAS No.: 5334-09-8
• Molecular Formula: C18H24O4
• Molecular Weight: 304.3808
• European Community (EC) Number: 226-250-2
• NSC Number: 67410,2387
• UNII: UQ2DXY88FP
• DSSTox Substance ID: DTXSID4063793
• Nikkaji Number: J217.893A
• Wikidata: Q81991011
• Mol file: 5334-09-8.mol

Synonyms:5334-09-8;Cyclohexyl 2-isobutyl phthalate;Cyclohexyl isobutyl phthalate;Phthalic acid, cyclohexyl isobutyl ester;UQ2DXY88FP;Isobutyl cyclohexyl phthalate;Phthalic acid 1-cyclohexyl 2-isobutyl ester;2-O-cyclohexyl 1-O-(2-methylpropyl) benzene-1,2-dicarboxylate;NSC-2387;NSC-67410;1,2-Benzenedicarboxylic acid, cyclohexyl 2-methylpropyl ester;1, cyclohexyl 2-methylpropyl ester;1,2-Benzenedicarboxylic acid, 1-cyclohexyl 2-(2-methylpropyl) ester;Phthalic Acid Cyclohexyl Isobutyl Ester;UNII-UQ2DXY88FP;SCHEMBL6402081;DTXSID4063793;NSC2387;NSC 2387;NSC67410;EINECS 226-250-2;NSC 67410;AI3-11105;1-CYCLOHEXYL 2-(2-METHYLPROPYL) 1,2-BENZENEDICARBOXYLATE

Chemical Property of Cyclohexyl 2-isobutyl phthalate

Chemical Property:

• Vapor Pressure: 5.24E-06mmHg at 25°C
• Boiling Point: 381°Cat760mmHg
• Flash Point: 181.4°C
• PSA: 52.60000
• Density: 1.1g/cm³
• LogP: 3.98890
• Storage Temp.: Refrigerator
• Solubility.: Chloroform, Hexanes
• XLogP3: 4.6
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 7
• Exact Mass: 304.16745924
• Heavy Atom Count: 22
• Complexity: 371

Purity/Quality:

99% ^*data from raw suppliers

PhthalicAcidCyclohexylIsobutylEster ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)COC(=O)C1=CC=CC=C1C(=O)OC2CCCCC2
• Uses: Phthalic Acid Cyclohexyl Isobutyl Ester is an phthalate esters used as plasticizers and additives. Used in toxiciology studies as well as risk assessment studies of food contamination that occurs via migration of phthalates into foodstuffs from food-contact materials (FCM). Phthalic Acid Cyclohexyl Isobutyl Ester is an phthalate esters used as plasticizers and additives. Used in toxiciology studies as well as risk assessment studies of food contamination that occurs via migration of phthalates into foodstuffs from food-contact materials (FCM).