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CAS No.: | 19984-57-7 |
---|---|
Name: | 1-(1-Adamantyl)pyridinium bromide |
Article Data: | 3 |
Molecular Structure: | |
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); |
Melting Point: | 245 °C (dec.)(lit.) |
Hazard Symbols: | |
Risk Codes: | 36/37/38 |
Safety: | 26-36 |
PSA: | 3.88000 |
LogP: | -0.09660 |
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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
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 Information about 1-(1-Adamantyl)pyridinium bromide (CAS NO.19984-57-7):
Hazard Codes: Xi
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