3-Ethoxy-2-cyclohexen-1-one
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3-Ethoxy-2-cyclohexen-1-one
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CAS No:
5323-87-5
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Formula:
C8H12O2
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Chemical Name:
3-Ethoxy-2-cyclohexen-1-one
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Synonyms:
2-Cyclohexen-1-one,3-ethoxy-;3-Ethoxy-2-cyclohexen-1-one;3-Ethoxy-2-cyclohexenone;3-Ethoxy-2-cyclohexene-1-one;NSC 2826;1-Ethoxy-2-cyclohexen-3-one;78877-13-1
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CAS No:
3-Ethoxy-2-cyclohexen-1-one Basic Attributes
140.18
140.18
2042049
226-190-7
2826
DTXSID30201326
2914509090
Characteristics
26.3
1
Off-white to peach Crystalline Powder
1.04
104-106 °C @ Press: 6 Torr
107 °C
1.503-1.505
Slightly soluble in water.
0-6°C
Safety Information
NONH for all modes of transport
3
24/25
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:140.18
XLogP3:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:140.083729621
Monoisotopic Mass:140.083729621
Topological Polar Surface Area:26.3
Heavy Atom Count:10
Complexity:159
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
