Caprylicacid-8-13C
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Caprylicacid-8-13C
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CAS No:
287111-08-4
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Formula:
13CH3(CH2)6CO2H
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Chemical Name:
Caprylicacid-8-13C
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Synonyms:
Octanoic acid-8-13C;(8-~13~C)Octanoic acid;SCHEMBL1332865;DTXSID80745806;Octanoic acid-8-13C, 99 atom % 13C
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CAS No:
Safety Information
|Danger|H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]|P260, P264, P280, P301+P330+P331, P303+P361+P353, P304+P340, P305+P351+P338, P310, P321, P363, P405, and P501|Aggregated GHS information provided by 38 companies from 1 notifications to the ECHA C&L Inventory.
Computed Properties
Molecular Weight:145.20
XLogP3:3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:6
Exact Mass:145.118384584
Monoisotopic Mass:145.118384584
Topological Polar Surface Area:37.3
Heavy Atom Count:10
Complexity:89.3
Isotope Atom Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes