2-(3-Hydroxy-1-adamantyl)-2-oxoacetic acid
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2-(3-Hydroxy-1-adamantyl)-2-oxoacetic acid
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CAS No:
709031-28-7
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Formula:
C12H16O4
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Chemical Name:
2-(3-Hydroxy-1-adamantyl)-2-oxoacetic acid
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Synonyms:
Tricyclo[3.3.1.13,7]decane-1-acetic acid,3-hydroxy-α-oxo-;3-Hydroxy-α-oxotricyclo[3.3.1.13,7]decane-1-acetic acid;2-(3-Hydroxy-1-adamantyl)-2-oxoacetic acid;2-(3-Hydroxyadamantan-1-yl)-2-oxoacetic acid
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CAS No:
2-(3-Hydroxy-1-adamantyl)-2-oxoacetic acid Basic Attributes
224.253
224.25
615-199-5
DTXSID10440377
2918990090
Characteristics
74.60000
-0.12
1.5±0.1 g/cm3
164-165 °C @ Solvent: Water
366.5±21.0 °C at 760 mmHg
189.7±18.6 °C
1.635
Safety Information
|Danger|H314 (80%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]|P260, P261, P264, P271, P280, P301+P330+P331, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P310, P312, P321, P332+P313, P337+P313, P362, P363, P403+P233, P405, and P501|Aggregated GHS information provided by 5 companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Computed Properties
Molecular Weight:224.25
XLogP3:0.8
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:2
Exact Mass:224.10485899
Monoisotopic Mass:224.10485899
Topological Polar Surface Area:74.6
Heavy Atom Count:16
Complexity:359
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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Business licensedTrader Supplier of Pharmaceutical intermediatesInquiryCAS No.: 709031-28-7Grade: Pharmaceutical GradeContent: 98.0% -
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2-(3-Hydroxy-1-adamantyl)-2-oxoacetic acid
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