Name: Name:1,7-DIMETHYLNAPHTHALENE
Brand: AABLOCKS
SKU: AA003DOW
Rating: 90 (10 reviews)

Catalog No.: AA003DOW

575-37-1 | 1,7-DIMETHYLNAPHTHALENE

Pack Size： 50mg

Purity：

3 weeks

$525.00 $367.00

Pack Size： 250mg

Purity：

3 weeks

$1,688.00 $1,181.00

Quantity

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Technical Information

Catalog Number: AA003DOW

Chemical Name: 1,7-DIMETHYLNAPHTHALENE

CAS Number: 575-37-1

Molecular Formula: C12H12

Molecular Weight: 156.2237

MDL Number: MFCD00060884

SMILES: Cc1ccc2c(c1)c(C)ccc2

NSC Number: 60773

Properties

BP: 263.0°C

Storage: 2-8℃;

Complexity: 150

Covalently-Bonded Unit Count: 1

Defined Atom Stereocenter Count: 0

Defined Bond Stereocenter Count: 0

Formal Charge: 0

Heavy Atom Count: 12

Hydrogen Bond Acceptor Count: 0

Hydrogen Bond Donor Count: 0

Isotope Atom Count: 0

Rotatable Bond Count: 0

Undefined Atom Stereocenter Count: 0

Undefined Bond Stereocenter Count: 0

XLogP3: 4.4

Literature fold

Title: Exploring QSAR and QAAR for inhibitors of cytochrome P450 2A6 and 2A5 enzymes using GFA and G/PLS techniques.

Journal: European journal of medicinal chemistry20090501

Title: Predictive three-dimensional quantitative structure-activity relationship of cytochrome P450 1A2 inhibitors.

Journal: Journal of medicinal chemistry20050602

Title: Quantitative structure-activity relationship analysis of inhibitors of the nicotine metabolizing CYP2A6 enzyme.

Journal: Journal of medicinal chemistry20050127

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