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diethyl 5-(hydroxymethyl)-3-methyl-1H-pyrrole-2,4-dicarboxylate

diethyl 5-(hydroxymethyl)-3-methyl-1H-pyrrole-2,4-dicarboxylate structure

CAS No:
5422-89-9
Formula:
C12H17NO5
Chemical Name:
diethyl 5-(hydroxymethyl)-3-methyl-1H-pyrrole-2,4-dicarboxylate
Synonyms:
5422-89-9;MLS000737932;5-(Hydroxymethyl)-3-methyl-1H-pyrrole-2,4-dicarboxylicacid diethyl ester;NSC10768;Pyrrole Analogue 3;CHEMBL1706165;BDBM15013;DTXSID30202575;HMS2885B13;ZINC1712457;NSC 10768;NSC-10768;1H-Pyrrole-2,4-dicarboxylic acid, 5-(hydroxymethyl)-3-methyl-, diethyl ester;NCGC00246716-01;SMR000528091;3,5-bisethoxycarbonyl-2-hydroxymethyl-4-methylpyrrole;1H-Pyrrole-2, 5-(hydroxymethyl)-3-methyl-, diethyl ester;2,4-diethyl 5-(hydroxymethyl)-3-methyl-1H-pyrrole-2,4-dicarboxylate;3-Methyl-5-(hydroxymethyl)-1H-pyrrole-2,4-dicarboxylic acid diethyl ester;1H-Pyrrole-2,4-dicarboxylic acid, 5- (hydroxymethyl)-3-methyl-, diethyl ester

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diethyl 5-(hydroxymethyl)-3-methyl-1H-pyrrole-2,4-dicarboxylate Basic Attributes

Molecular Weight：

255.27 g/mol

Exact Mass：

255.11067264 g/mol

NSC Number：

10768

DSSTox ID：

DTXSID30202575

Characteristics

PSA：

88.6 Å²

Computed Properties

Molecular Weight:255.27
XLogP3:1
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:7
Exact Mass:255.11067264
Monoisotopic Mass:255.11067264
Topological Polar Surface Area:88.6
Heavy Atom Count:18
Complexity:307
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of diethyl 5-(hydroxymethyl)-3-methyl-1H-pyrrole-2,4-dicarboxylate

Basic Attributes
Characteristics
Computed Properties
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