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Dimethyl 5-methoxypyrrolidine-1,2-dicarboxylate

HCID 14523830
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Basic information

CAS
83486-98-0
Standard SMILES
COC(=O)C1CCC(OC)N1C(=O)OC
InChIKey
RXDFZGINLOTVLC-UHFFFAOYSA-N
Molecular formula
C9H15NO5
Average molar mass
217.22 g/mol
Monoisotopic mass
217.09502258

Names & identifiers

Preferred name
Dimethyl 5-methoxypyrrolidine-1,2-dicarboxylate
IUPAC
dimethyl 5-methoxypyrrolidine-1,2-dicarboxylate

Names & synonyms

Dimethyl 5-methoxypyrrolidine-1,2-dicarboxylate83486-98-0DTXSID40561261RefChem:338645DTXCID205120395-Methoxy-pyrrolidine-1,2-dicarboxylic acid dimethyl ester

Database identifiers

CAS
83486-98-0
PubChem CID
14523830
DTXSID
DTXSID40561261

Properties

Computed structural properties

XLogP
0.6
Topological polar surface area
65.1 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
5
Rotatable bonds
4
Heavy atoms
15
Formal charge
0
Complexity
255

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Related reactions

5 records
New reaction record
HRID 684007 reaction equation
HRID 684007As productTraining data from https://doi.org/10.1039/C8SC04228D (3/10)
HRID 958050 reaction equation
HRID 958050As reactantValidation data from https://doi.org/10.1039/C8SC04228D
HRID 1549830 reaction equation
HRID 1549830As reactantTraining data from https://doi.org/10.1039/C8SC04228D (1/10)
HRID 2134417 reaction equation
HRID 2134417As reactantTraining data from https://doi.org/10.1039/C8SC04228D (4/10)
HRID 2144970 reaction equation
HRID 2144970As productTraining data from https://doi.org/10.1039/C8SC04228D (4/10)

Compound notes

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