Product Code

TRC-B279782

Product Format

Neat

Molecular Formula

C21 D5 H33 N . Br

Molecular Weight

389.468

Product Categories

TRC, Additional pharmaceutical toxicology reference materials, Ammonium salts, Stable isotopes, Pharmaceutical Toxicology Reference Materials

Product Type

Stable Isotope Labelled

Unlabelled CAS Number

7281-04-1

Drug Type

Other Drugs & Biomarkers

Price and availability

48-hour USA dispatch time

Freight restricted.

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Product Information

Chemical Data

Analyte Name

Benzyldodecyldimethylammonium-d5 Bromide

Molecular Formula

C21 D5 H33 N . Br

Molecular Weight

389.468

Accurate Mass

388.25

SMILES

[Br-].[2H]c1c([2H])c([2H])c(C[N+](C)(C)CCCCCCCCCCCC)c([2H])c1[2H]

InChI

InChI=1S/C21H38N.BrH/c1-4-5-6-7-8-9-10-11-12-16-19-22(2,3)20-21-17-14-13-15-18-21;/h13-15,17-18H,4-12,16,19-20H2,1-3H3;1H/q+1;/p-1/i13D,14D,15D,17D,18D;

IUPAC

dodecyl-dimethyl-[(2,3,4,5,6-pentadeuteriophenyl)methyl]azanium;bromide

Unlabelled CAS Number

7281-04-1

SIL Type

Deuterium

Product Data

Storage Temperature

-20°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Type

Stable Isotope Labelled

Product Format

Neat

Product Description

Labelled benzalkonium bromides. Benzalkonium bromides are an important class of cationic surfactants. They are used as preservatives for ophthalmic, nasal and parenteral products and they are also used as a topical antiseptic and medical equipment disinfectant.

References: Maitani, Y., et al.: Chem. Pharm. Bull., 44, 403 (1996), Fang, J., et al.: Int. J. Pharm., 178, 83 (1999), Iordanskii, A., et al.: Eur. J. Pharm. Biopharm., 49, 287 (2000), Powers, J., et al.: Biochemistry, 44, 15504 (2005),

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Benzyldodecyldimethylammonium-d5 Bromide

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