Dimethyldioctadecylammonium bromide

Catalog Number	ACM3700672-2
CAS	3700-67-2
Structure
Synonyms	Dioctadecyl dimethyl ammonium bromide
IUPAC Name	dimethyl(dioctadecyl)azanium;bromide
Molecular Weight	630.95
Molecular Formula	C38H80BrN
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
Purity	99%
Density	1.047 g/cm³
Appearance	Off-white solid
Storage	-20 °C
Complexity	391
Covalently-Bonded Unit Count	2
Defined Atom Stereocenter Count	0
EC Number	223-037-6
Exact Mass	629.54741
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

Knowledge & Learning Case Study 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.

Our products and services are for research use only and cannot be used for any clinical purposes.

Online Inquiry

Dimethyldioctadecylammonium bromide (3700-67-2)

Send A Message