2-Oxoheptanedioic acid
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2-Oxoheptanedioic acid
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CAS No:
17126-90-8
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Formula:
C7H10O5
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Chemical Name:
2-Oxoheptanedioic acid
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Synonyms:
Heptanedioic acid,2-oxo-;2-Oxoheptanedioic acid;α-Ketopimelic acid;α-Oxopimelic acid;2-Oxopimelic acid
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CAS No:
Description
2-oxopimelic acid is an oxo dicarboxylic acid that is pimelic acid carrying a single oxo substituent at position 2. It derives from a pimelic acid. It is a conjugate acid of a 2-oxopimelate(2-).
Safety Information
|Warning|H302 (97.44%): Harmful if swallowed [Warning Acute toxicity, oral]|P264, P270, P301+P312, P330, and P501|Aggregated GHS information provided by 39 companies from 2 notifications to the ECHA C&L Inventory.
Computed Properties
Molecular Weight:174.15
XLogP3:-0.2
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:6
Exact Mass:174.05282342
Monoisotopic Mass:174.05282342
Topological Polar Surface Area:91.7
Heavy Atom Count:12
Complexity:196
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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