Adamantyl bromomethyl ketone
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Adamantyl bromomethyl ketone
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CAS No:
5122-82-7
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Formula:
C12H17BrO
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Chemical Name:
Adamantyl bromomethyl ketone
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Synonyms:
Ethanone,2-bromo-1-tricyclo[3.3.1.13,7]dec-1-yl-;Ketone,1-adamantyl bromomethyl;2-Bromo-1-tricyclo[3.3.1.13,7]dec-1-ylethanone;1-Adamantyl bromomethyl ketone;1-(Bromoacetyl)adamantane;1-(1-Adamantyl)-2-bromoethanone;Adamantyl bromomethyl ketone;2-Bromo-(1-tricyclo[3.3.1.13,7]dec-1-yl)ethanone;1-(Adamantan-1-yl)-2-bromoethanone;1-(1-Adamantyl)-2-bromoethan-1-one;1-Bromo-2-(1-adamantyl)ethan-2-one;1-(Adamantan-1-yl)-2-bromoethan-1-one
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CAS No:
Characteristics
17.07000
3.16680
White crystalline powder
1.439g/cm3
78-79 °C @ Solvent: Methanol
320.3ºC at 760 mmHg
61.1ºC
1.575
Safety Information
IRRITANT
NONH for all modes of transport
3
36/37/38
26-37/39-36/37/39-27
Xi
P261-P305 + P351 + P338
H315-H319-H335
|Warning|H315 (97.5%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 40 companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Computed Properties
Molecular Weight:257.17
XLogP3:3.3
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:2
Exact Mass:256.04628
Monoisotopic Mass:256.04628
Topological Polar Surface Area:17.1
Heavy Atom Count:14
Complexity:230
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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