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ethyl 4-[2-(4-iodobenzoyl)oxyacetyl]-2,5-dimethyl-1H-pyrrole-3-carboxylate

ethyl 4-[2-(4-iodobenzoyl)oxyacetyl]-2,5-dimethyl-1H-pyrrole-3-carboxylate structure

CAS No:
729586-61-2
Formula:
C18H18INO5
Chemical Name:
ethyl 4-[2-(4-iodobenzoyl)oxyacetyl]-2,5-dimethyl-1H-pyrrole-3-carboxylate
Synonyms:
ZINC3292334;AKOS033707176;MCULE-5897310705;Z19775772;ethyl 4-[2-(4-iodobenzoyloxy)acetyl]-2,5-dimethyl-1H-pyrrole-3-carboxylate;729586-61-2

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ethyl 4-[2-(4-iodobenzoyl)oxyacetyl]-2,5-dimethyl-1H-pyrrole-3-carboxylate Basic Attributes

Molecular Weight：

455.2 g/mol

Exact Mass：

455.02297 g/mol

Characteristics

PSA：

85.5 Å²

Computed Properties

Molecular Weight:455.2
XLogP3:3.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:8
Exact Mass:455.02297
Monoisotopic Mass:455.02297
Topological Polar Surface Area:85.5
Heavy Atom Count:25
Complexity:504
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of ethyl 4-[2-(4-iodobenzoyl)oxyacetyl]-2,5-dimethyl-1H-pyrrole-3-carboxylate

Basic Attributes
Characteristics
Computed Properties
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