4-Oxo-4,5,6,7-tetrahydro-1-benzofuran-3-carboxylic acid
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4-Oxo-4,5,6,7-tetrahydro-1-benzofuran-3-carboxylic acid
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CAS No:
56671-28-4
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Formula:
C9H8O4
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Chemical Name:
4-Oxo-4,5,6,7-tetrahydro-1-benzofuran-3-carboxylic acid
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Synonyms:
4-oxo-6,7-dihydro-5H-1-benzofuran-3-carboxylic acid;
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CAS No:
4-Oxo-4,5,6,7-tetrahydro-1-benzofuran-3-carboxylic acid Basic Attributes
180.15700
180.04225873 g/mol
DTXSID80351926
2932999099
Safety Information
R36/37/38
S26; S36/37/39
|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|Aggregated GHS information provided by 38 companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Computed Properties
Molecular Weight:180.16
XLogP3:0.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:1
Exact Mass:180.04225873
Monoisotopic Mass:180.04225873
Topological Polar Surface Area:67.5
Heavy Atom Count:13
Complexity:248
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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