Isodecyl diphenyl phosphate

• CAS: 29761-21-5
• Catalog Number: ACM29761215-2
• Category: Main Products
• Molecular Weight: 390.5
• Molecular Formula: C22H31O4P
• Synonyms: Phosphoric acid, isodecyl diphenyl ester
• IUPAC Name: 8-Methylnonyl diphenyl phosphate
• Canonical SMILES: CC(C)CCCCCCCOP(=O)(OC1=CC=CC=C1)OC2=CC=CC=C2
• InChI: InChI=1S/C22H31O4P/c1-20(2)14-8-4-3-5-13-19-24-27(23,25-21-15-9-6-10-16-21)26-22-17-11-7-12-18-22/h6-7,9-12,15-18,20H,3-5,8,13-14,19H2,1-2H3
• InChI Key: RYUJRXVZSJCHDZ-UHFFFAOYSA-N
• Boiling Point: 110.6 °C
• Melting Point: -93 °C
• Flash Point: 40 °F (4 °C) (cc)
• Density: 1.070 g/cm3
• Appearance: Clear, colourless liquid.
• Storage: Ambient (>5 °C)
• Alpha Sort: Isodecyl diphenyl phosphate
• Complexity: 391
• Covalently-Bonded Unit Count: 1
• Defined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Exact Mass: 390.19599646
• Formal Charge: 0
• Heavy Atom Count: 27
• Hydrogen Bond Acceptor Count: 4
• Hydrogen Bond Donor Count: 0
• Isotope Atom Count: 0
• Monoisotopic Mass: 390.19599646
• Packing Group: III
• Physical State: Liquid
• Rotatable Bond Count: 13
• Topological Polar Surface Area: 44.8 Ų
• Undefined Atom Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• Viscosity: 21.9cs (25°C)

Custom Q&A

What is the molecular formula of isodecyl diphenyl phosphate?

The molecular formula of isodecyl diphenyl phosphate is C22H31O4P.

What is the molecular weight of isodecyl diphenyl phosphate?

The molecular weight of isodecyl diphenyl phosphate is 390.5 g/mol.

What is the IUPAC name of isodecyl diphenyl phosphate?

The IUPAC name of isodecyl diphenyl phosphate is 8-methylnonyl diphenyl phosphate.

What is the InChIKey of isodecyl diphenyl phosphate?

The InChIKey of isodecyl diphenyl phosphate is RYUJRXVZSJCHDZ-UHFFFAOYSA-N.

What is the canonical SMILES of isodecyl diphenyl phosphate?

The canonical SMILES of isodecyl diphenyl phosphate is CC(C)CCCCCCCOP(=O)(OC1=CC=CC=C1)OC2=CC=CC=C2.

What is the CAS number of isodecyl diphenyl phosphate?

The CAS number of isodecyl diphenyl phosphate is 29761-21-5.

What is the UNII number of isodecyl diphenyl phosphate?

The UNII number of isodecyl diphenyl phosphate is 2927JBB380.

What is the XLogP3-AA value of isodecyl diphenyl phosphate?

The XLogP3-AA value of isodecyl diphenyl phosphate is 7.4.

How many hydrogen bond donor counts does isodecyl diphenyl phosphate have?

Isodecyl diphenyl phosphate has 0 hydrogen bond donor counts.

How many rotatable bond counts does isodecyl diphenyl phosphate have?

Isodecyl diphenyl phosphate has 13 rotatable bond counts.