CAS 28804-88-8 | Naphthalene, dimethyl- | CAS Number 28804-88-8

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28804-88-8 | Naphthalene, dimethyl-

CAS No: 28804-88-8 Catalog No: AG002WKL MDL No:MFCD00004120

Product Description

Catalog Number:

AG002WKL

Chemical Name:

Naphthalene, dimethyl-

CAS Number:

28804-88-8

Molecular Formula:

C12H12

Molecular Weight:

156.2237

MDL Number:

MFCD00004120

IUPAC Name:

2,6-dimethylnaphthalene

InChI:

InChI=1S/C12H12/c1-9-3-5-12-8-10(2)4-6-11(12)7-9/h3-8H,1-2H3

InChI Key:

YGYNBBAUIYTWBF-UHFFFAOYSA-N

SMILES:

Cc1ccc2c(c1C)cccc2

EC Number:

209-464-0

UNII:

76U29QW3FM

NSC Number:

36852

Properties

Complexity:

132

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

156.094g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

156.228g/mol

Monoisotopic Mass:

156.094g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

0A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

4.3

Literature

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Macrocyclic hosts for fullerenes: extreme changes in binding abilities with small structural variations.	Journal of the American Chemical Society 20110309
Distribution, levels, and risk assessment of polycyclic aromatic hydrocarbons (PAHs) in some water bodies along the coastal belt of Ghana.	TheScientificWorldJournal 20100101
Navajo coal combustion and respiratory health near Shiprock, New Mexico.	Journal of environmental and public health 20100101
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A pyrene-degrading consortium from deep-sea sediment of the West Pacific and its key member Cycloclasticus sp. P1.	Environmental microbiology 20080801
A comparison of substrate dynamics in human CYP2E1 and CYP2A6.	Biochemical and biophysical research communications 20070126
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Predictive three-dimensional quantitative structure-activity relationship of cytochrome P450 1A2 inhibitors.	Journal of medicinal chemistry 20050602
Quantitative structure-activity relationship analysis of inhibitors of the nicotine metabolizing CYP2A6 enzyme.	Journal of medicinal chemistry 20050127
Elimination rate constants of 46 polycyclic aromatic hydrocarbons in the unionid mussel, Elliptio complanata.	Archives of environmental contamination and toxicology 20041001
Association behavior of fluorine-containing and non-fluorine-containing methacrylate-based amphiphilic diblock copolymer in aqueous media.	Langmuir : the ACS journal of surfaces and colloids 20040817
Anaerobic oxidation of crude oil hydrocarbons by the resident microorganisms of a contaminated anoxic aquifer.	Environmental science & technology 20031115
Naphtho[1,2-c:5,6-c]difuran: a reactive linker and cyclophane precursor.	The Journal of organic chemistry 20031031
Estimation of selected physicochemical properties for methylated naphthalene compounds.	Chemosphere 20030801
Biotransformation of p-xylene and 2,6-dimethylnaphthalene by xylene monooxygenase cloned from a Sphingomonas isolate.	Applied microbiology and biotechnology 20020901
Active site characteristics of CYP4B1 probed with aromatic ligands.	Biochemistry 20010724