3-ethoxy-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxopropanoic acid
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![3-ethoxy-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxopropanoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/c9a43ba4a6394198b3eb2ff7d1ae404c.png "3-ethoxy-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxopropanoic acid")
3-ethoxy-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxopropanoic acid
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CAS No:
137401-45-7
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Formula:
C10H17NO6
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Chemical Name:
3-ethoxy-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxopropanoic acid
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Synonyms:
2-((tert-Butoxycarbonyl)amino)-3-ethoxy-3-oxopropanoic acid; N-boc-2-aminomalonic acid monoethyl ester; 2-tert-Butoxycarbonylaminomalonic acid monoethyl ester; ethyl tert-butoxycarbonyl-DL-aminomalonate;
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CAS No:
3-ethoxy-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxopropanoic acid Basic Attributes
247.24500
247.10558726
DTXSID20451838
2924199090
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 2 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Computed Properties
Molecular Weight:247.24
XLogP3:1
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:7
Exact Mass:247.10558726
Monoisotopic Mass:247.10558726
Topological Polar Surface Area:102
Heavy Atom Count:17
Complexity:306
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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