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Ethyl 2-(2-(1,3-dioxoisoindolin-2-yl)acetamido)acetate

HCID 344872
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Basic informationOverviewNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
2641-02-3
Standard SMILES
CCOC(=O)CNC(=O)CN1C(=O)c2ccccc2C1=O
InChIKey
PDGSHECKBBYNNJ-UHFFFAOYSA-N
Molecular formula
C14H14N2O5
Average molar mass
290.27 g/mol
Monoisotopic mass
290.09027155

Overview

See also: N-Phthaloylglycylglycine ethyl ester (annotation moved to).

Names & identifiers

Preferred name
Ethyl 2-(2-(1,3-dioxoisoindolin-2-yl)acetamido)acetate
IUPAC
ethyl 2-[[2-(1,3-dioxoisoindol-2-yl)acetyl]amino]acetate
English name
ethyl 2-[2-(1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl)acetamido]acetate
Molecular formula
C14H14N2O5
Molecular weight
290.27136

Names & synonyms

2641-02-3Ethyl (2-(1,3-dioxoisoindolin-2-yl)acetyl)glycinateEthyl 2-(2-(1,3-dioxoisoindolin-2-yl)acetamido)acetateST50585034Ethyl 2-[2-(1,3-Dioxoisoindolin-2-yl)acetamido]acetateethyl N-[(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)acetyl]glycinateN-(Phthalimidoacetyl)glycine Ethyl EsterNSC402011DTXSID50322769MFCD00087016STK045719AKOS003238505
Show more names
ethyl 2-[[2-(1,3-dioxoisoindol-2-yl)acetyl]amino]acetateethyl 2-[2-(1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl)acetamido]acetate
NSC-402011SY397366CS-0336125ethyl 2-[2-(1,3-dioxobenzo[c]azolin-2-yl)acetylamino]acetate2-[[2-(1,3-dioxo-isoindol-2-yl)-acetyl]amino]-acetic acid ethyl esterethyl {[(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)acetyl]amino}acetate

Database identifiers

CAS
2641-02-3
PubChem CID
344872

Properties

Computed structural properties

XLogP
0.5
Topological polar surface area
92.8 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
5
Rotatable bonds
6
Heavy atoms
21
Formal charge
0
Complexity
438

Physicochemical properties

Symbol(GHS)
7 · GHS07,GHS09
Signal word
Warning
Hazard statements
400 · H400-H302
Precautionary statements
273 · P273-P391-P501-P264-P270-P301+P312-P330-P501

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

Safety data

Signal word
Warning
Symbol(GHS)
GHS07,GHS09
Hazard statements
H400-H302
Precautionary statements
P273-P391-P501-P264-P270-P301+P312-P330-P501

Chemistry & industry

Applications · 1 item

UsesN-(Phthalimidoacetyl)glycine Ethyl Ester is an intermediate used in the synthesis of Rilmazafone Hydrochloride (R509715), which can be used in biological study of nitrazepam or rilmazafone hydrochloride combined with ethanol effects on human memory. It is also used as sleep aid medication.

Suppliers1 total

西格玛奥德里奇(上海)贸易有限公司21-20338288 · [email protected]

Related reactions

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Compound notes

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On this pageBasic informationOverviewNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
DTXSID
DTXSID50322769