Dicyclohexyl phthalate-3,4,5,6-d4

Base Information

• Chemical Name: Dicyclohexyl phthalate-3,4,5,6-d4
• CAS No.: 358731-25-6
• Molecular Formula: C20H22 D4 O4
• Molecular Weight: 334.44
• DSSTox Substance ID: DTXSID70583592
• Wikidata: Q82475180
• Mol file: 358731-25-6.mol

Synonyms:Dicyclohexyl phthalate-3,4,5,6-d4;358731-25-6;Dicyclohexyl Phthalate-d4;dicyclohexyl 3,4,5,6-tetradeuteriobenzene-1,2-dicarboxylate;Phthalic acid, bis-cyclohexyl ester D4;d4-dicyclohexyl phthalate;Dicyclohexyl (~2~H_4_)benzene-1,2-dicarboxylate;DTXSID70583592;HY-W009142S;Phthalic Acid Dicyclohexyl Ester-d4;1ST1115D4;CID 16212235;CS-0214200;D99233;1,2-Benzenedicarboxylic Acid 1,2-Dicyclohexyl Ester-d4;Dicyclohexyl phthalate-3,4,5,6-d4, analytical standard;1,2-Benzene-3,4,5,6-d4-dicarboxylic acid, dicyclohexyl ester;Dicyclohexyl phthalate-d4

Chemical Property of Dicyclohexyl phthalate-3,4,5,6-d4

Chemical Property:

• Vapor Pressure: 1.87E-07mmHg at 25°C
• Refractive Index: 1.544
• Boiling Point: 425.8oC at 760 mmHg
• Flash Point: 206.6oC
• PSA: 52.60000
• Density: 1.15g/cm3
• LogP: 4.66560
• Storage Temp.: Refrigerator
• Solubility.: Chloroform (Slightly), Methanol (Slightly, Heated)
• XLogP3: 5.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 6
• Exact Mass: 334.20821629
• Heavy Atom Count: 24
• Complexity: 381

Purity/Quality:

99% ^*data from raw suppliers

DicyclohexylPhthalate-d4 ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: C1CCC(CC1)OC(=O)C2=CC=CC=C2C(=O)OC3CCCCC3
• Isomeric SMILES: [2H]C1=C(C(=C(C(=C1[2H])C(=O)OC2CCCCC2)C(=O)OC3CCCCC3)[2H])[2H]
• Uses: Dicyclohexyl Phthalate-3,4,5,6-d4, a phthalate ester used as a plasticizer as well as being present in cosmetic products. Dicyclohexyl Phthalate that is a weak drug-type inducer of hepatic xenobiotic metabolism. Labelled analogue of Dicyclohexyl Phthalate, a phthalate ester used as a plasticizer as well as being present in cosmetic products. Dicyclohexyl Phthalate that is a weak drug-type inducer of hepatic xenobiotic metabolism.