dimethyl 2-[(4-nitrophenyl)methyl]propanedioate
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dimethyl 2-[(4-nitrophenyl)methyl]propanedioate
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CAS No:
124090-10-4
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Formula:
C12H13NO6
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Chemical Name:
dimethyl 2-[(4-nitrophenyl)methyl]propanedioate
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Synonyms:
dimethyl 2-(4'-nitrobenzyl)malonate; (4-nitro-benzyl)-malonic acid dimethyl ester; Propanedioic acid,2-[(4-nitrophenyl)methyl]-,1,3-dimethyl ester; dimethyl (4-nitrobenzyl)propanedioate; DIMETHYL (4-NITROBENZYL)MALONATE; (4-Nitro-benzyl)-malonsaeure-dimethylester; 2-Carbomethoxy-3-(4-nitrophenyl)propanoic acid dimethyl ester;Expand
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CAS No:
dimethyl 2-[(4-nitrophenyl)methyl]propanedioate Basic Attributes
267.23500
267.07428713
DTXSID30400039
Safety Information
R36/37/38
26-37/39
Xi
|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:267.23
XLogP3:2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:6
Exact Mass:267.07428713
Monoisotopic Mass:267.07428713
Topological Polar Surface Area:98.4
Heavy Atom Count:19
Complexity:327
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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