1,3-Diethyl 2-nitropropanedioate
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1,3-Diethyl 2-nitropropanedioate
structure -
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CAS No:
603-67-8
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Formula:
C7H11NO6
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Chemical Name:
1,3-Diethyl 2-nitropropanedioate
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Synonyms:
Propanedioic acid,2-nitro-,1,3-diethyl ester;Malonic acid,nitro-,diethyl ester;Propanedioic acid,nitro-,diethyl ester;1,3-Diethyl 2-nitropropanedioate;Diethyl nitromalonate;NSC 140874;Diethyl 2-nitromalonate
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CAS No:
1,3-Diethyl 2-nitropropanedioate Basic Attributes
205.17
205.17
210-052-8
140874
DTXSID20209058
2917190090
Safety Information
NONH for all modes of transport
3
R36/37/38
26-37/39
Xi: Irritant;
P261-P305 + P351 + P338
H315-H319-H335
|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:205.17
XLogP3:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:6
Exact Mass:205.05863707
Monoisotopic Mass:205.05863707
Topological Polar Surface Area:98.4
Heavy Atom Count:14
Complexity:215
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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1,3-Diethyl 2-nitropropanedioate
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