CAS 84-77-5 | Didecyl Phthalate | CAS Number 84-77-5

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84-77-5 | Didecyl Phthalate

CAS No: 84-77-5 Catalog No: AG0034PN MDL No:MFCD00041915

Product Description

Catalog Number:

AG0034PN

Chemical Name:

Didecyl Phthalate

CAS Number:

84-77-5

Molecular Formula:

C28H46O4

Molecular Weight:

446.6624

MDL Number:

MFCD00041915

IUPAC Name:

didecyl benzene-1,2-dicarboxylate

InChI:

InChI=1S/C28H46O4/c1-3-5-7-9-11-13-15-19-23-31-27(29)25-21-17-18-22-26(25)28(30)32-24-20-16-14-12-10-8-6-4-2/h17-18,21-22H,3-16,19-20,23-24H2,1-2H3

InChI Key:

PGIBJVOPLXHHGS-UHFFFAOYSA-N

SMILES:

CCCCCCCCCCOC(=O)c1ccccc1C(=O)OCCCCCCCCCC

EC Number:

201-561-6

UNII:

FI5FBN947Z

NSC Number:

15319

Properties

Complexity:

420

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

446.34g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

446.672g/mol

Monoisotopic Mass:

446.34g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

52.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

11.2

Literature

Title	Journal
Phthalates efficiently bind to human peroxisome proliferator activated receptor and retinoid X receptor α, β, γ subtypes: an in silico approach.	Journal of applied toxicology : JAT 20140701
Subcritical water extraction for the remediation of phthalate ester-contaminated soil.	Journal of hazardous materials 20110915
Environmental Burkholderia cepacia strain Cs5 acting by two analogous alkyl-quinolones and a didecyl-phthalate against a broad spectrum of phytopathogens fungi.	Current microbiology 20110501
Hexamoll DINCH plasticised PVC containers for the storage of platelets.	Asian journal of transfusion science 20110101
Storage of Buffy-coat-derived platelets in additive solutions: in vitro effects on platelets prepared by the novel TACSI system and stored in plastic containers with different gas permeability.	Vox sanguinis 20101101