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5-acetyl-2,4-dimethyl-pyrrole-3-carboxylicaciethylester

5-acetyl-2,4-dimethyl-pyrrole-3-carboxylicaciethylester structure

CAS No:
6314-22-3
Formula:
C11H15NO3
Chemical Name:
5-acetyl-2,4-dimethyl-pyrrole-3-carboxylicaciethylester
Synonyms:
Nsc40232;ethyl 5-acetyl-2,4-dimethyl-1H-pyrrole-3-carboxylate;ethyl 5-ethanoyl-2,4-dimethyl-1H-pyrrole-3-carboxylate;5-acetyl-2,4-dimethyl-pyrrole-3-carboxylicaciethylester;5-acetyl-2,4-dimethyl-pyrrole-3-carboxylicacidethylester;PYRROLE-3-CARBOXYLIC ACID, 5-ACETYL-2,4-DIMETHYL-, ETHYL ESTER;1H-Pyrrole-3-carboxylic acid, 5-acetyl-2,4-dimethyl-, ethyl ester

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5-acetyl-2,4-dimethyl-pyrrole-3-carboxylicaciethylester Basic Attributes

Molecular Weight：

209.2417

Exact Mass：

209.10500

NSC Number：

63924|40232

DSSTox ID：

DTXSID00212484

HScode：

2933990090

Characteristics

PSA：

59.2

XLogP3：

2.01080

Density：

1.123g/cm3

Boiling Point：

379.6ºC at 760 mmHg

Flash Point：

183.4ºC

Refractive Index：

1.521

Safety Information

Hazard category：

IRRITANT

Computed Properties

Molecular Weight:209.24
XLogP3:1.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:209.10519334
Monoisotopic Mass:209.10519334
Topological Polar Surface Area:59.2
Heavy Atom Count:15
Complexity:265
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 5-acetyl-2,4-dimethyl-pyrrole-3-carboxylicaciethylester

Basic Attributes
Characteristics
Safety Information
Computed Properties

5-acetyl-2,4-dimethyl-pyrrole-3-carboxylicaciethylester

SDS

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