methyl 1-chloro-4-hydroxyisoquinoline-3-carboxylate
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methyl 1-chloro-4-hydroxyisoquinoline-3-carboxylate
structure -
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CAS No:
223388-20-3
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Formula:
C11H8ClNO3
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Chemical Name:
methyl 1-chloro-4-hydroxyisoquinoline-3-carboxylate
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CAS No:
methyl 1-chloro-4-hydroxyisoquinoline-3-carboxylate Basic Attributes
237.63900
237.0192708
DTXSID70595675
2933499090
Safety Information
R41
26-39
Xi
|Danger|H318 (100%): Causes serious eye damage [Danger Serious eye damage/eye irritation]|P280, P305+P351+P338, and P310|Aggregated GHS information provided by 39 companies from 2 notifications to the ECHA C&L Inventory.
Computed Properties
Molecular Weight:237.64
XLogP3:3.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:2
Exact Mass:237.0192708
Monoisotopic Mass:237.0192708
Topological Polar Surface Area:59.4
Heavy Atom Count:16
Complexity:274
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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