21636-03-3
5-CYANO-3-METHYL-1H-PYRROLE-2-CARBOXYLIC ACID ETHYL ESTER
Name
5-CYANO-3-METHYL-1H-PYRROLE-2-CARBOXYLIC ACID ETHYL ESTER
Formula
C9 H10 N2 O2
MolWeight
178.19
1Identification
【Name】
5-CYANO-3-METHYL-1H-PYRROLE-2-CARBOXYLIC ACID ETHYL ESTER
【CAS】
【MDL】
MFCD13178627
【English Synonyms】
【Formula】
C9 H10 N2 O2
【MolWeight】
178.19
【Inchi】
InChI=1S/C9H10N2O2/c1-3-13-9(12)8-6(2)4-7(5-10)11-8/h4,11H,3H2,1-2H3
【InChIKey】
InChIKey=GTHHZKOVRJSARL-UHFFFAOYSA-N
【SMILES】
CCOC(=O)c1c(cc([nH]1)C#N)C
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:4
XLogP3:1.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
5-CYANO-3-METHYL-1H-PYRROLE-2-CARBOXYLIC ACID ETHYL ESTER.cml
Quick Release
3-AMINO-3-(3,5-DIFLUORO-2-HYDROXYPHENYL)PROPANOIC ACID
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3-AMINO-3-(3,5-DIBROMO-2-HYDROXY-PHENYL)-PROPIONIC ACID
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ETHYL 3-AMINO-1,5-DIMETHYL-1H-PYRROLE-2-CARBOXYLATE
83621-89-0
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