4-iodocubane-1-carboxylic acid
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4-iodocubane-1-carboxylic acid
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CAS No:
111873-46-2
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Formula:
C9H7IO2
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Chemical Name:
4-iodocubane-1-carboxylic acid
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Synonyms:
4-iodocubane-1-carboxylic acid;NSC640892;111873-46-2;(1s,2R,3r,8S)-4-iodocubane-1-carboxylic acid;4-Iodo-1-cubanecarboxylic acid;CHEMBL1908958;SCHEMBL15055615;ZINC1626437;8-IODOCUBANE-1-CARBOXYLIC ACID;NSC-640892;NCI60_013642
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CAS No:
Safety Information
|Warning|H315 (100%): 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|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Computed Properties
Molecular Weight:274.05
XLogP3:0.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:273.94908
Monoisotopic Mass:273.94908
Topological Polar Surface Area:37.3
Heavy Atom Count:12
Complexity:315
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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