Dimethyldioctadecylammonium bromide

• CAS: 3700-67-2
• Catalog Number: ACM3700672-2
• Category: Main Products
• Molecular Weight: 630.95
• Molecular Formula: C38H80BrN
• Synonyms: Dioctadecyl dimethyl ammonium bromide
• IUPAC Name: dimethyl(dioctadecyl)azanium;bromide
• Canonical SMILES: CCCCCCCCCCCCCCCCCC[N+](C)(C)CCCCCCCCCCCCCCCCCC.[Br-]
• InChI: InChI=1S/C38H80N.BrH/c1-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-39(3,4)38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-2;/h5-38H2,1-4H3;1H/q+1;/p-1
• InChI Key: PSLWZOIUBRXAQW-UHFFFAOYSA-M
• Melting Point: ~160 °C
• Density: 1.047 g/cm³
• Appearance: Off-white solid
• Storage: -20 °C
• Active Content: 90%
• Complexity: 391
• Covalently-Bonded Unit Count: 2
• Defined Atom Stereocenter Count: 0
• EC Number: 223-037-6
• Exact Mass: 629.54741
• Formal Charge: 0
• H-Bond Acceptor: 1
• Heavy Atom Count: 40
• Hydrogen Bond Acceptor Count: 1
• Hydrogen Bond Donor Count: 0
• Isomeric SMILES: CCCCCCCCCCCCCCCCCC[N+](C)(C)CCCCCCCCCCCCCCCCCC.[Br-]
• MDL Number: MFCD00041975
• Monoisotopic Mass: 629.54741
• Physical State: Solid
• Rotatable Bond Count: 34
• Topological Polar Surface Area: 0 Ų
• UNII: Z5T47R065A

Custom Q&A

What is the molecular formula of Dimethyldioctadecylammonium Bromide?

The molecular formula of Dimethyldioctadecylammonium Bromide is C38H80BrN.

What is the molecular weight of Dimethyldioctadecylammonium Bromide?

The molecular weight of Dimethyldioctadecylammonium Bromide is 631.0 g/mol.

What is the IUPAC name of Dimethyldioctadecylammonium Bromide?

The IUPAC name of Dimethyldioctadecylammonium Bromide is dimethyl(dioctadecyl)azanium;bromide.

What is the InChI code of Dimethyldioctadecylammonium Bromide?

The InChI code of Dimethyldioctadecylammonium Bromide is InChI=1S/C38H80N.BrH/c1-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-39(3,4)38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-2;/h5-38H2,1-4H3;1H/q+1;/p-1.

What is the canonical SMILES of Dimethyldioctadecylammonium Bromide?

The canonical SMILES of Dimethyldioctadecylammonium Bromide is CCCCCCCCCCCCCCCCCC[N+](C)(C)CCCCCCCCCCCCCCCCCC.[Br-].

What is the CAS number of Dimethyldioctadecylammonium Bromide?

The CAS number of Dimethyldioctadecylammonium Bromide is 3700-67-2.

What is the related CAS number of Dimethyldioctadecylammonium Bromide?

The related CAS number of Dimethyldioctadecylammonium Bromide is 14357-21-2 (Parent).

What is the molecular weight of Dimethyldioctadecylammonium?

The molecular weight of Dimethyldioctadecylammonium is not mentioned in the reference.

How many hydrogen bond donor counts does Dimethyldioctadecylammonium Bromide have?

Dimethyldioctadecylammonium Bromide has 0 hydrogen bond donor count.

How many hydrogen bond acceptor counts does Dimethyldioctadecylammonium Bromide have?

Dimethyldioctadecylammonium Bromide has 1 hydrogen bond acceptor count.