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19984-57-7

Basic Information
CAS No.: 19984-57-7
Name: 1-(1-Adamantyl)pyridinium bromide
Article Data: 3
Cas Database
Molecular Structure:
Molecular Structure of 19984-57-7 (1-(1-Adamantyl)pyridinium bromide)
Formula: C15H20BrN
Molecular Weight: 294.23
Synonyms: Pyridinium,1-(1-adamantyl)-, bromide (8CI);Pyridinium, 1-tricyclo[3.3.1.13,7]dec-1-yl-,bromide (9CI);N-1-Adamantylpyridinium bromide;Pyridinium,1-tricyclo[3.3.1.13,7]dec-1-yl-, bromide (1:1);
EINECS: N/A
Density: N/A
Melting Point: 245 °C (dec.)(lit.)
Boiling Point: N/A
Flash Point: N/A
Solubility: N/A
Appearance: N/A
Hazard Symbols:
Risk Codes: 36/37/38
Safety: 26-36
Transport Information: N/A
PSA: 3.88000
LogP: -0.09660
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    CAS 19984-57-7

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    Systematic Name: 1-(Tricyclo[3.3.1.1~3,7~]dec-1-yl)pyridinium bromide Molecular Structure: Molecular Formula: C15H20BrN Molecular Weight: 294.23 CAS NO: 19984-57-7 H bond acceptors: 1 H bond donors: 0 Freely Rotating Bonds: 1 Po

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Chemistry

Systematic Name: 1-(Tricyclo[3.3.1.1~3,7~]dec-1-yl)pyridinium bromide
Molecular Structure:
Molecular Formula: C15H20BrN
Molecular Weight: 294.23
CAS NO: 19984-57-7
H bond acceptors: 1
H bond donors: 0
Freely Rotating Bonds: 1
Polar Surface Area: Å2 
SMILES: [Br-].C1C3CC2(CC1CC(C2)C3)[n+]4ccccc4
InChI: InChI=1/C15H20N.BrH/c1-2-4-16(5-3-1)15-9-12-6-13(10-15)8-14(7-12)11-15;/h1-5,12-14H,6-11H2;1H/q+1;/p-1
InChIKey: AXXUSTFZAJVTMK-REWHXWOFAB
Std. InChI: InChI=1S/C15H20N.BrH/c1-2-4-16(5-3-1)15-9-12-6-13(10-15)8-14(7-12)11-15;/h1-5,12-14H,6-11H2;1H/q+1;/p-1
Std. InChIKey: AXXUSTFZAJVTMK-UHFFFAOYSA-M 
Product Categories of 1-(1-Adamantyl)pyridinium bromide (CAS NO.19984-57-7): Adamantane derivatives;Heterocyclic Compounds;C9 to C46;Heterocyclic Building Blocks;Pyridines

Safety Profile

Safety Information about 1-(1-Adamantyl)pyridinium bromide (CAS NO.19984-57-7):
Hazard Codes: IrritantXi
Risk Statements: 36/37/38 
R36/37/38: Irritating to eyes, respiratory system and skin.
Safety Statements: 26-36 
S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. 
S36: Wear suitable protective clothing.
WGK Germany: 3