1,3-Dihydro-3-oxo-1-isobenzofuranacetic acid
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1,3-Dihydro-3-oxo-1-isobenzofuranacetic acid
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CAS No:
4743-58-2
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Formula:
C10H8O4
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Chemical Name:
1,3-Dihydro-3-oxo-1-isobenzofuranacetic acid
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Synonyms:
1-Isobenzofuranacetic acid,1,3-dihydro-3-oxo-;1-Phthalanacetic acid,3-oxo-;1,3-Dihydro-3-oxo-1-isobenzofuranacetic acid;3-Phthalideacetic acid;Benzenepropanoic acid,2-carboxy-β-hydroxy-,γ-lactone;(3-Oxo-1,3-dihydro-2-benzofuran-1-yl)acetic acid;2-(3-Oxo-1H-2-benzofuran-1-yl)acetic acid;2-(3-Oxo-1,3-dihydro-2-benzofuran-1-yl)acetic acid;2-(3-Oxo-1,3-dihydroisobenzofuran-1-yl)acetic acid
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CAS No:
1,3-Dihydro-3-oxo-1-isobenzofuranacetic acid Basic Attributes
192.16800
192.17
DTXSID60343440
2932209090
Safety Information
R36/37/38
S26-S36
Xi
P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, P501
H302
|Warning|H302 (20%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 5 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Computed Properties
Molecular Weight:192.17
XLogP3:0.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:2
Exact Mass:192.04225873
Monoisotopic Mass:192.04225873
Topological Polar Surface Area:63.6
Heavy Atom Count:14
Complexity:261
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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1,3-Dihydro-3-oxo-1-isobenzofuranacetic acid
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