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(4-Methoxy-1-methyl-2,5-dihydro-1H-pyrrole-2,3-diyl)bis(methylene) bis(hydrogen ethylcarbonimidate)

HCID 42298
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Basic information

CAS
57432-51-6
Standard SMILES
CCNC(=O)OCC1=C(OC)CN(C)C1COC(=O)NCC
InChIKey
JPMMFGYRFGUBKH-UHFFFAOYSA-N
Molecular formula
C14H25N3O5
Average molar mass
315.37 g/mol
Monoisotopic mass
315.17942091

Names & identifiers

Preferred name
(4-Methoxy-1-methyl-2,5-dihydro-1H-pyrrole-2,3-diyl)bis(methylene) bis(hydrogen ethylcarbonimidate)
IUPAC
[3-(ethylcarbamoyloxymethyl)-4-methoxy-1-methyl-2,5-dihydropyrrol-2-yl]methyl N-ethylcarbamate

Names & synonyms

57432-51-6DTXSID00972915(4-Methoxy-1-methyl-2,5-dihydro-1H-pyrrole-2,3-diyl)bis(methylene) bis(hydrogen ethylcarbonimidate)RefChem:1050430DTXCID8014003762,5-Dihydro-4-methoxy-1-methyl-1H-pyrrole-2,3-dimethanol bis(ethylcarbamate)Synthanecine C bis-N-ethylcarbamate3-Pyrroline-2,3-dimethanol, 4-methoxy-1-methyl-, bis(ethylcarbamate)1H-Pyrrole-2,3-dimethanol, 2,5-dihydro-4-methoxy-1-methyl-, bis(ethylcarbamate)Carbamic acid, ethyl-, (2,5-dihydro-4-methoxy-1-methyl-1H-pyrrole-2,3-diyl)bis(methylene)ester

Database identifiers

CAS
57432-51-6
PubChem CID
42298
DTXSID
DTXSID00972915

Properties

Computed structural properties

XLogP
-0.3
Topological polar surface area
89.1 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
6
Rotatable bonds
9
Heavy atoms
22
Formal charge
0
Complexity
425

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