Name: 1-tetradecylpyridinium bromide
SKU: 1155-74-4

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Basic Information

Molecular Structure:
CAS No.:	1155-74-4
Name:	1-tetradecylpyridinium bromide
Article Data:	11

Formula:	C₁₉H₃₄BrN
Molecular Weight:	356.39
Synonyms:	1-Tetradecylpyridiniumbromide (6CI,7CI);Pyridinium, 1-tetradecyl-, bromide (8CI,9CI);Fixanol VR;Fylomac 90;Morpan TPB;Myristylpyridinium bromide;N-Myristylpyridiniumbromide;N-Tetradecylpyridinium bromide;Tetradecylpyridinium bromide;
EINECS:	214-586-2
Melting Point:	65-67 °C
PSA:	3.88000
LogP:	2.67920

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Specification

The Pyridinium, 1-tetradecyl-, bromide (1:1), with the CAS registry number 1155-74-4, is also known as Tetradecylpyridinium bromide. And its EINECS registry number is 214-586-2. This chemical's molecular formula is C₁₉H₃₄BrN and molecular weight is 356.38. What's more, its IUPAC name is 1-Tetradecylpyridin-1-ium bromide. Besides, this chemical can be used as preservative and surfactant.

Physical properties about Pyridinium, 1-tetradecyl-, bromide (1:1) are: (1)ACD/LogP: 0.84; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.84; (4)ACD/LogD (pH 7.4): 0.84; (5)ACD/BCF (pH 5.5): 2.55; (6)ACD/BCF (pH 7.4): 2.55; (7)ACD/KOC (pH 5.5): 67.95; (8)ACD/KOC (pH 7.4): 67.95; (9)#H bond acceptors: 1; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 13; (12)Polar Surface Area: 3.88 Å².

You can still convert the following datas into molecular structure:
(1) SMILES: [Br-].[n+]1(ccccc1)CCCCCCCCCCCCCC
(2) InChI: InChI=1/C19H34N.BrH/c1-2-3-4-5-6-7-8-9-10-11-12-14-17-20-18-15-13-16-19-20;/h13,15-16,18-19H,2-12,14,17H2,1H3;1H/q+1;/p-1
(3) InChIKey: HJNAJKBRYDFICV-REWHXWOFAU