Heptanedioic acid, 4-oxo-, 1,7-diethyl ester
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Heptanedioic acid, 4-oxo-, 1,7-diethyl ester
structure -
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CAS No:
6317-49-3
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Formula:
C11H18O5
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Chemical Name:
Heptanedioic acid, 4-oxo-, 1,7-diethyl ester
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Synonyms:
Heptanedioic acid,4-oxo-,1,7-diethyl ester;Heptanedioic acid,4-oxo-,diethyl ester;Diethyl γ-ketopimelate;Diethyl 4-ketopimelate;γ-Oxopimelic acid diethyl ester;Diethyl 4-oxopimelate;Diethyl 4-oxoheptanedioate;Diethyl γ-oxopimelate;4-Oxopimelic acid diethyl ester;NSC 39476;1,7-Diethyl 4-oxoheptanedioate
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CAS No:
Heptanedioic acid, 4-oxo-, 1,7-diethyl ester Basic Attributes
230.26
230.26
228-657-0
39476
DTXSID50212510
2918300090
Characteristics
69.7
0.8
1.0855 g/cm3 @ Temp: 20 °C
58 °C @ Solvent: Benzene, Ligroine
182 °C @ Press: 20 Torr
137.4±21.0 °C
1.441
Safety Information
NONH for all modes of transport
3
S23-S24/25
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|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Computed Properties
Molecular Weight:230.26
XLogP3:0.8
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:10
Exact Mass:230.11542367
Monoisotopic Mass:230.11542367
Topological Polar Surface Area:69.7
Heavy Atom Count:16
Complexity:223
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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Heptanedioic acid, 4-oxo-, 1,7-diethyl ester
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