Dimethylditetradecylammonium bromide supplier

Name
Dimethylditetradecylammonium bromide
EINECS 268-474-3
CAS No. 68105-02-2
Article Data1
CAS DataBase
Density
Solubility
Melting Point 167-169 °C
Formula C₃₀H₆₄BrN
Boiling Point
Molecular Weight 518.749
Flash Point
Transport Information
Appearance
Safety 26-37/39
Risk Codes 36/37/38
Molecular Structure
Hazard Symbols
Synonyms 1-Tetradecanaminium,N,N-dimethyl-N-tetradecyl-, bromide (9CI);Di-n-tetradecyldimethylammoniumbromide;Dimethyldimyristylammonium bromide;Dimethylditetradecylammoniumbromide;Dimyristyldimethylammonium bromide;Ditetradecyldimethylammoniumbromide;
PSA 0.00000
LogP 7.46900

Dimethylditetradecylammonium bromide Specification

The Dimethylditetradecylammonium bromide, with the CAS registry number 68105-02-2, is also known as 1-Tetradecanaminium,N,N-dimethyl-N-tetradecyl-, bromide and Ditetradecyldimethylammonium bromide. It belongs to the product categories of Ammonium Bromides (Quaternary) and Quaternary Ammonium Compounds. Its EINECS registry number is 268-474-3. This chemical's molecular formula is C₃₀H₆₄BrN and molecular weight is 518.74. What's more, its IUPAC name is Dimethyl-di(tetradecyl)azanium bromide and systematic name is called N,N-Dimethyl-N-tetradecyltetradecan-1-aminium bromide.

Physical properties about this chemical are: (1) ACD/LogP: 5.96; (2) # of Rule of 5 Violations: 1; (3) ACD/LogD (pH 5.5): 5.96; (4) ACD/LogD (pH 7.4): 5.96; (5) ACD/BCF (pH 5.5): 20066.68; (6) ACD/BCF (pH 7.4): 20066.68; (7) ACD/KOC (pH 5.5): 41811.75; (8) ACD/KOC (pH 7.4): 41811.75; (9) #H bond acceptors: 1; (10) #H bond donors: 0; (11) #Freely Rotating Bonds: 26; (12) Polar Surface Area: 0 Å²; (13) Melting point: 167-169 °C.

When you are dealing with Dimethylditetradecylammonium bromide, you should be very careful. This chemical is irritating to eyes, respiratory system, skin and may cause inflammation to the skin or other mucous membranes. Therefore, you should wear suitable gloves and eye/face protection. And in case of contact with eyes, you should rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
(1) SMILES: [Br-].C(CCCCC[N+](C)(CCCCCCCCCCCCCC)C)CCCCCCCC
(2) InChI: InChI=1/C30H64N.BrH/c1-5-7-9-11-13-15-17-19-21-23-25-27-29-31(3,4)30-28-26-24-22-20-18-16-14-12-10-8-6-2;/h5-30H2,1-4H3;1H/q+1;/p-1
(3) InChIKey: IRMGVPILCPGYNQ-REWHXWOFAH

Product Name

Dimethylditetradecylammonium bromide

Dimethylditetradecylammonium bromide Specification

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