CAS 1346604-79-2|Bis(8-methylnonyl) 1,2-(2H4)benzenedicarboxylate

Introduction：Basic information about CAS 1346604-79-2|Bis(8-methylnonyl) 1,2-(2H4)benzenedicarboxylate, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.

Table of Contents

1. Names
2. BiologicalActivity
3. Chemical & Physical Properties
4. Synonyms

Common Name	Bis(8-methylnonyl) 1,2-(2H4)benzenedicarboxylate
CAS Number	1346604-79-2	Molecular Weight	450.687
Density	1.0±0.1 g/cm3	Boiling Point	425.8±13.0 °C at 760 mmHg
Molecular Formula	C₂₈H₄₂D₄O₄	Melting Point	/
MSDS	/	Flash Point	227.6±9.3 °C

Names

Name	Diisodecyl Phthalate-d4
Synonym	More Synonyms

BiologicalActivity

Description	Bis(8-methyl-1-nonyl) Phthalate-3,4,5,6-d4 is the deuterium labeled Bis(8-methyl-1-nonyl) Phthalate[1].
Related Catalog	Research Areas >>OthersSignaling Pathways >>Others >>Others
In Vitro	Stable heavy isotopes of hydrogen, carbon, and other elements have been incorporated into drug molecules, largely as tracers for quantitation during the drug development process. Deuteration has gained attention because of its potential to affect the pharmacokinetic and metabolic profiles of drugs[1].
References	[1]. Russak EM, et al. Impact of Deuterium Substitution on the Pharmacokinetics of Pharmaceuticals. Ann Pharmacother. 2019 Feb;53(2):211-216.

Chemical & Physical Properties

Density	1.0±0.1 g/cm3
Boiling Point	425.8±13.0 °C at 760 mmHg
Molecular Formula	C₂₈H₄₂D₄O₄
Molecular Weight	450.687
Flash Point	227.6±9.3 °C
Exact Mass	450.364716
PSA	52.60000
LogP	10.83
Vapour Pressure	0.0±1.0 mmHg at 25°C
Index of Refraction	1.487
InChIKey	ZVFDTKUVRCTHQE-OLNJRPQYSA-N
SMILES	CC(C)CCCCCCCOC(=O)c1ccccc1C(=O)OCCCCCCCC(C)C
Storage condition	2-8°C

Synonyms

1,2-Benzene-d-dicarboxylic acid, bis(8-methylnonyl) ester

Bis(8-methylnonyl) 1,2-(H)benzenedicarboxylate

bis(8-methylnonyl) 3,4,5,6-tetradeuteriobenzene-1,2-dicarboxylate

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