diethyl 2-[(pyrimidin-2-ylamino)methylidene]propanedioate
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![diethyl 2-[(pyrimidin-2-ylamino)methylidene]propanedioate structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/a980d40329d4412c94ae713b53aaabce.png "diethyl 2-[(pyrimidin-2-ylamino)methylidene]propanedioate")
diethyl 2-[(pyrimidin-2-ylamino)methylidene]propanedioate
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CAS No:
21025-62-7
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Formula:
C12H15N3O4
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Chemical Name:
diethyl 2-[(pyrimidin-2-ylamino)methylidene]propanedioate
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Synonyms:
21025-62-7;2-(Pyrimidin-2-ylaminomethylene)-malonic acid diethyl ester;1,3-Diethyl 2-{[(pyrimidin-2-yl)amino]methylidene}propanedioate;diethyl 2-((pyrimidin-2-ylamino)methylene)malonate;diethyl 2-[(pyrimidin-2-ylamino)methylidene]propanedioate;DTXSID60364433;MFCD02333244;STL331600;AKOS000539735;ZINC100262560;MCULE-1970797748;ST50191181;AB00114074-01;diethyl ((pyrimidin-2-yl)aminomethylene)malonate;3W-0817;SR-01000488065;SR-01000488065-1;diethyl [(pyrimidin-2-ylamino)methylidene]propanedioate;F0920-1855;DIETHYL 2-((2-PYRIMIDINYLAMINO)METHYLENE)MALONATE;diethyl 2-[(pyrimidin-2-ylamino)methylene]propane-1,3-dioate;Propanedioic acid, 2-[(2-pyrimidinylamino)methylene]-, 1,3-diethyl ester
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CAS No:
diethyl 2-[(pyrimidin-2-ylamino)methylidene]propanedioate Basic Attributes
265.26 g/mol
265.10625597 g/mol
DTXSID60364433
Safety Information
|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:265.26
XLogP3:1.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:8
Exact Mass:265.10625597
Monoisotopic Mass:265.10625597
Topological Polar Surface Area:90.4
Heavy Atom Count:19
Complexity:318
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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