CAS 7281-04-1 Benzyldodecyldimethylammonium bromide

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Benzyldodecyldimethylammonium bromide

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Catalog Number

ACM7281041-3

CAS Number

7281-04-1

Product Name

Benzyldodecyldimethylammonium bromide

Structure

Category

Polymerization Additives

Synonyms

Benzyldimethyldodecylammonium bromide

IUPAC Name

benzyl-dodecyl-dimethylazanium;bromide

Molecular Weight

384.44

Molecular Formula

C21H38BrN

Canonical SMILES

CCCCCCCCCCCC[N+](C)(C)CC1=CC=CC=C1.[Br-];

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

InChI Key

KHSLHYAUZSPBIU-UHFFFAOYSA-M

Melting Point

50-55 °C

Flash Point

110 °C

Purity

≥96.5%

Appearance

Powder

Application

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.

Storage

2-8°C

Assay

0.98

Complexity

240

Covalently-Bonded Unit Count

EC Number

230-698-4

Exact Mass

383.21876

Formal Charge

Heavy Atom Count

Hydrogen Bond Acceptor Count

Hydrogen Bond Donor Count

Isomeric SMILES

CCCCCCCCCCCC[N+](C)(C)CC1=CC=CC=C1.[Br-]

MDL Number

MFCD00011768

Monoisotopic Mass

383.21876

Packaging

1 kg

Rotatable Bond Count

Storage Conditions

2-8°C

Topological Polar Surface Area

0 Å²

UNII

IRY12B2TQ6

MSDS

Download MSDS

COA

Download COA

Spec Sheet

Download Spec Sheet

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7281-04-1
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