3,4-Dihydroisocoumarin
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3,4-Dihydroisocoumarin
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CAS No:
4702-34-5
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Formula:
C9H8O2
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Chemical Name:
3,4-Dihydroisocoumarin
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Synonyms:
1H-2-Benzopyran-1-one,3,4-dihydro-;Isocoumarin,3,4-dihydro-;3,4-Dihydro-1H-2-benzopyran-1-one;1-Isochromanone;3,4-Dihydroisocoumarin;3,4-Dihydroisochromen-1-one
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CAS No:
Description
ChEBI: The simplest member of the class of dihydroisocoumarins that is the 3,4-dihydro derivative of isocoumarin.
3,4-dihydroisocoumarin is the simplest member of the class of dihydroisocoumarins that is the 3,4-dihydro derivative of isocoumarin. It derives from an isocoumarin.
3,4-Dihydroisocoumarin Basic Attributes
148.16
148.16
225-179-4
994Y8F08R6
DTXSID60197006
2932209090
Characteristics
26.3
1.8
1.203 g/cm3 @ Temp: 18.5 °C
37-39 °C
165 °C @ Press: 16 Torr
132.1±22.2 °C
1.562
Safety Information
P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, P501
H315
|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 2 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Computed Properties
Molecular Weight:148.16
XLogP3:1.8
Hydrogen Bond Acceptor Count:2
Exact Mass:148.052429494
Monoisotopic Mass:148.052429494
Topological Polar Surface Area:26.3
Heavy Atom Count:11
Complexity:165
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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