Name: Name:1,2-Benzenedicarboxylic acid, 1-isodecyl ester
Brand: AABLOCKS
SKU: AA0031XD
Rating: 90 (10 reviews)

Technical Information

Catalog Number: AA0031XD

Chemical Name: 1,2-Benzenedicarboxylic acid, 1-isodecyl ester

CAS Number: 31047-64-0

Molecular Formula: C18H25O4-

Molecular Weight: 305.3887

MDL Number: MFCD28963558

SMILES: CC(CCCCCCCOC(=O)c1ccccc1C(=O)[O-])C

Properties

Complexity: 338

Covalently-Bonded Unit Count: 1

Defined Atom Stereocenter Count: 0

Defined Bond Stereocenter Count: 0

Formal Charge: 0

Heavy Atom Count: 22

Hydrogen Bond Acceptor Count: 4

Hydrogen Bond Donor Count: 1

Isotope Atom Count: 0

Rotatable Bond Count: 11

Undefined Atom Stereocenter Count: 0

Undefined Bond Stereocenter Count: 0

XLogP3: 6.1

Literature fold

Title: Human biological monitoring of diisononyl phthalate and diisodecyl phthalate: a review.

Journal: Journal of environmental and public health20120101

Title: Biodegradation of diisodecyl phthalate (DIDP) by Bacillus sp. SB-007.

Journal: Journal of basic microbiology20090901

Title: Ultra-trace determination of phthalate ester metabolites in seawater, sediments, and biota from an urbanized marine inlet by LC/ESI-MS/MS.

Journal: Environmental science & technology20090815

Title: Urinary metabolites of diisodecyl phthalate in rats.

Journal: Toxicology20070701

Title: Assessment of human exposure to di-isodecyl phthalate using oxidative metabolites as biomarkers.

Journal: Biomarkers : biochemical indicators of exposure, response, and susceptibility to chemicals20070101

Title: Monophthalates promote IL-6 and IL-8 production in the human epithelial cell line A549.

Journal: Toxicology in vitro : an international journal published in association with BIBRA20040601

Title: Comparative effects of phthalate monoesters on gap junctional intercellular communication and peroxisome proliferation in rodent and primate hepatocytes.

Journal: Journal of toxicology and environmental health. Part A20020426

Title: Adjuvant and immuno-suppressive effect of six monophthalates in a subcutaneous injection model with BALB/c mice.

Journal: Toxicology20011201

31047-64-0 | 1,2-Benzenedicarboxylic acid, 1-isodecyl ester