3-Pentynoicacid
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3-Pentynoicacid
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CAS No:
36781-65-4
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Formula:
C5H6O2
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Chemical Name:
3-Pentynoicacid
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Synonyms:
3-Pentynoic acid;Pent-3-ynoic acid;NIZKVZYBUGUDTI-UHFFFAOYSA-N
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CAS No:
Safety Information
|Danger|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P310, P312, P321, P332+P313, P362, P403+P233, P405, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
3-Pentynoicacid Use and Manufacturing
3-Pentynoic Acid is a chemical reagent used in the preparation of small-molecule inhibitors of geranylgeranyltransferase Type I. In addition it is used in the synthesis of Salinosporamide A, a proteasome inhibitor with anti-cancer properties.
Computed Properties
Molecular Weight:98.10
XLogP3:0.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:98.036779430
Monoisotopic Mass:98.036779430
Topological Polar Surface Area:37.3
Heavy Atom Count:7
Complexity:124
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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